SCHEMBL4740561

SCHEMBL4740561

CC(=O)Nc1cc2ccccc2c(Nc2cccc(Cl)c2)n1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 4/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ KDM4E B2RXH2 3/20 0.49
▸ MAPT P10636 2/20 0.49
▸ BRAF P15056 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ PDE5A O76074 2/20 0.48
▸ FADS1 O60427 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ CSNK2A2 P19784 1/20 0.46
▸ CSNK2B P67870 1/20 0.46
▸ CSNK2A1 P68400 1/20 0.46
▸ PIM1 P11309 4/20 0.45
▸ PIM2 Q9P1W9 4/20 0.45
▸ EGFR P00533 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ KDM1A O60341 1/20 0.44

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
SCHEMBL4413271 0.80 ADORA3 (0.49) MEN1KMT2AKDM4EMAPTPIM2
SCHEMBL4741984 0.77 EGFR (0.58) ABCG2MEN1KMT2AKDM4EMAPT
SCHEMBL25770211 0.77 ADORA3 (0.47) KDM4EPIM2
SCHEMBL13716352 0.75 AURKA (0.53) ABCG2MEN1KMT2APDE5AFADS1
SCHEMBL357999 0.72 MEN1 (0.71) MEN1KMT2AMAPTALDH1A1HTT
SCHEMBL4934856 0.71 FADS1 (0.55) ABCG2BRAFMAPK1FADS1ALDH1A1
SCHEMBL12535696 0.71 CSNK2A1 (0.64) ALDH1A1CSNK2A2CSNK2BCSNK2A1PIM1
SCHEMBL12539809 0.71 ADORA3 (0.49) KDM4EPIM2
SCHEMBL4740531 0.71 PDE5A (0.64) ABCG2MEN1KMT2AKDM4EMAPT
SCHEMBL4933191 0.71 TNF (0.64) ABCG2MEN1KMT2AKDM4EMAPT

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008089307-A2 DELTA 5 DESATURASE INHIBITORS FOR THE TREATMENT OF PAIN, INFLAMMATION AND CANCER LEXICON PHARMACEUTICALS, INC. (US) 2008-07-24 — — WO claimed
WO-2008089310-A2 DELTA 5 DESATURASE INHIBITORS FOR THE TREATMENT OF OBESITY LEXICON PHARMACEUTICALS, INC. (US) 2008-07-24 — — WO claimed
US-20240216316-A1 DIHOMO-GAMMA LINOLENIC ACID (DGLA) IS A NOVEL SENOLYTIC BUCK INST RES AGING (US) 2024-07-04 — — US disclosed
US-20080200458-A1 Methods and compositions for the treatment of body composition disorders LEXICON PHARMACEUTICALS, INC. 2008-08-21 — — US disclosed
US-20080194557-A1 Methods and compositions for the treatment of pain, inflammation and cancer LEXICON PHARMACEUTICALS, INC. 2008-08-14 — — US disclosed
WO-2008089307-A2 DELTA 5 DESATURASE INHIBITORS FOR THE TREATMENT OF PAIN, INFLAMMATION AND CANCER LEXICON PHARMACEUTICALS, INC. (US) 2008-07-24 — — WO disclosed
WO-2008089310-A2 DELTA 5 DESATURASE INHIBITORS FOR THE TREATMENT OF OBESITY LEXICON PHARMACEUTICALS, INC. (US) 2008-07-24 — — WO 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 (3 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-20080194557-A1 Methods and compositions for the treatment of pain, inflammation and cancer TNF, IL6, CXCL8 ABCG2 4326/4885MEN1 3245/4885KMT2A 3920/4885
US-20240216316-A1 DIHOMO-GAMMA LINOLENIC ACID (DGLA) IS A NOVEL SENOLYTIC DAGLA, DAGLB, MGLL ABCG2 4056/4885MEN1 3106/4885KMT2A 2832/4885
US-20080200458-A1 Methods and compositions for the treatment of body composition disorders CPT1B, CPT1A, SHBG ABCG2 2597/4885MEN1 1919/4885KMT2A 3148/4885

“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.

Send feedback