SCHEMBL5074753

SCHEMBL5074753

c1ccc(-c2nc(-c3ccc(-c4nc(-c5ccccc5)c(-c5ccccc5)[nH]4)cc3)[nH]c2-c2ccccc2)cc1

nearest known ligand 0.96

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 11/20 0.83
MAPK12 P53778 11/20 0.83
MAPK11 Q15759 11/20 0.83
MAPK14 Q16539 11/20 0.83
GCGR P47871 6/20 0.83
RAF1 P04049 5/20 0.80
MAPK9 P45984 1/20 0.79
NOX1 Q9Y5S8 1/20 0.75
TP53 P04637 2/20 0.71
MAPT P10636 2/20 0.71
BRAF P15056 1/20 0.71
ALOX5 P09917 1/20 0.71
KDM4E B2RXH2 1/20 0.69
ALDH1A1 P00352 1/20 0.69
GLA P06280 1/20 0.69
GAA P10253 1/20 0.69
HPGD P15428 1/20 0.69
KMT2A Q03164 1/20 0.69
PTPN1 P18031 1/20 0.68

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16667652 0.98 MAPK13 (0.83) MAPK13MAPK12MAPK11MAPK14GCGR
SCHEMBL104130 0.98 MAPK13 (0.82) MAPK13MAPK12MAPK11MAPK14GCGR
Benzene SCHEMBL28852698 0.98 MAPK13 (0.82) MAPK13MAPK12MAPK11MAPK14GCGR
Methane SCHEMBL3278320 0.96 MAPK13 (0.79) MAPK13MAPK12MAPK11MAPK14GCGR
SCHEMBL27850480 0.96 MAPK13 (0.79) MAPK13MAPK12MAPK11MAPK14GCGR
SCHEMBL3456136 0.92 MAPK13 (0.74) MAPK13MAPK12MAPK11MAPK14GCGR
SCHEMBL739928 0.91 MAPK13 (0.72) MAPK13MAPK12MAPK11MAPK14GCGR
SCHEMBL23710761 0.91 KDM4E (0.78) MAPK13MAPK12MAPK11MAPK14GCGR
SCHEMBL9619859 0.91 MAPK13 (0.85) MAPK13MAPK12MAPK11MAPK14GCGR
SCHEMBL2127491 0.91 MAPK13 (0.85) MAPK13MAPK12MAPK11MAPK14GCGR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 39 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9452989-B2 Compounds, sensors, methods, and systems for detecting gamma radiation UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2016-09-27 US claimed
US-20150118758-A1 COMPOUNDS, SENSORS, METHODS, AND SYSTEMS FOR DETECTING GAMMA RADIATION UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2015-04-30 US claimed
WO-2013177539-A1 COMPOUNDS, SENSORS, METHODS, AND SYSTEMS FOR DETECTING GAMMA RADIATION UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2013-11-28 WO claimed
JP-3128357-A None JP disclosed
EP-4642465-A1 A CANCER ASSOCIATED FIBROBLAST (CAF) INHIBITOR FOR USE WITH AN ALTERNATING ELECTRIC FIELD IN A METHOD OF TREATING DISEASES SUCH AS CANCER Novocure GmbH (CH) 2025-11-05 EP disclosed
WO-2024141952-A1 A CANCER ASSOCIATED FIBROBLAST (CAF) INHIBITOR FOR USE WITH AN ALTERNATING ELECTRIC FIELD IN A METHOD OF TREATING DISEASES SUCH AS CANCER NOVOCURE GMBH (CH) 2024-07-04 WO disclosed
US-20240216403-A1 METHODS AND COMPOSITIONS FOR INHIBITING FIBROBLAST ACTIVATION BIOPHARMA CREDIT PLC (GB) 2024-07-04 US disclosed
US-11779583-B2 Tricyclic amino containing compounds for treatment or prevention of symptoms associated with endocrine dysfunction EMORY UNIVERSITY (US) 2023-10-10 US disclosed
US-11285151-B2 Tricyclic amino containing compounds for treatment or prevention of symptoms associated with endocrine dysfunction EMORY UNIVERSITY (US) 2022-03-29 US disclosed
US-20210401836-A1 TRICYCLIC AMINO CONTAINING COMPOUNDS FOR TREATMENT OR PREVENTION OF SYMPTOMS ASSOCIATED WITH ENDOCRINE DYSFUNCTION EMORY UNIVERSITY (US) 2021-12-30 US disclosed
US-10632120-B2 Tricyclic amino containing compounds for treatment or prevention of symptoms associated with endocrine dysfunction EMORY UNIVERSITY (US) 2020-04-28 US disclosed
US-7329715-B2 Abrasion resistant coatings by siloxane oligomers YAZAKI CORPORATION (JP) 2008-02-12 US disclosed
US-20070112061-A1 Heat- or singlet oxygen-generating agents and cancer treatment compositions comprising organic peroxide or chemiluminescent compound MANAC INC. (JP) 2007-05-17 US disclosed
US-20070112061-A1 Heat- or singlet oxygen-generating agents and cancer treatment compositions comprising organic peroxide or chemiluminescent compound MANAC INC. (JP) 2007-05-17 US disclosed
US-20070054930-A1 CXCR4 antagonists for the treatment of medical disorders EMORY UNIVERSITY 2007-03-08 US disclosed
US-20070054930-A1 CXCR4 antagonists for the treatment of medical disorders EMORY UNIVERSITY 2007-03-08 US disclosed
US-20060235178-A1 Abrasion resistant coatings by siloxane oligomers STOWE WOODWARD LLC 2006-10-19 US disclosed
US-5904994-A OXAZOLE, IMIDAZOLE, QUINOLINE AND PYRAZINE COMPOUNDS; WHITE LIGHT EMITTERS LUCENT TECHNOLOGIES INC. (US) 1999-05-18 US disclosed
EP-0763965-A2 Blue-emitting materials and electroluminescent devices containing these materials LUCENT TECHNOLOGIES INC. (US) 1997-03-19 EP disclosed
JP-H03128357-A NOVEL FLUORESCENT SUBSTANCE JAPAN CARLIT CO LTD:THE 1991-05-31 JP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070112061-A1 Heat- or singlet oxygen-generating agents and cancer treatment compositions comprising organic peroxide or chemiluminescent compound HSPE1, MCL1, HMOX1 MAPK13 1707/4885MAPK12 861/4885MAPK11 714/4885
US-20150118758-A1 COMPOUNDS, SENSORS, METHODS, AND SYSTEMS FOR DETECTING GAMMA RADIATION RAD50, MRE11, IRF3 MAPK13 3656/4885MAPK12 2323/4885MAPK11 2628/4885
US-20210401836-A1 TRICYCLIC AMINO CONTAINING COMPOUNDS FOR TREATMENT OR PREVENTION OF SYMPTOMS ASSOCIATED WITH ENDOCRINE DYSFUNCTION SHBG, ABAT, GLS MAPK13 2184/4885MAPK12 2658/4885MAPK11 2335/4885
US-11285151-B2 Tricyclic amino containing compounds for treatment or prevention of symptoms associated with endocrine dysfunction SHBG, ABAT, GLS MAPK13 2184/4885MAPK12 2658/4885MAPK11 2335/4885
US-10632120-B2 Tricyclic amino containing compounds for treatment or prevention of symptoms associated with endocrine dysfunction SHBG, ABAT, GLS MAPK13 2184/4885MAPK12 2658/4885MAPK11 2335/4885
US-20070054930-A1 CXCR4 antagonists for the treatment of medical disorders CXCR4, CXCL12, CXCR1 MAPK13 1248/4885MAPK12 1041/4885MAPK11 810/4885
US-11779583-B2 Tricyclic amino containing compounds for treatment or prevention of symptoms associated with endocrine dysfunction SHBG, ABAT, GLS MAPK13 2184/4885MAPK12 2658/4885MAPK11 2335/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.