SCHEMBL2701753

SCHEMBL2701753

[c]1[nH]c(-c2n[nH]c3ccccc23)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.53
KDM4E B2RXH2 3/20 0.53
GAA P10253 2/20 0.53
ALDH1A1 P00352 2/20 0.53
TTK P33981 2/20 0.53
ALPL P05186 1/20 0.53
HPGD P15428 1/20 0.53
MAPK10 P53779 1/20 0.53
LRRK2 Q5S007 2/20 0.46
ITK Q08881 4/20 0.44
FGFR1 P11362 1/20 0.44
FLT1 P17948 1/20 0.44
AURKA O14965 1/20 0.44
MAP2K4 P45985 2/20 0.43
PDPK1 O15530 1/20 0.43
CYP3A4 P08684 1/20 0.43
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
RAB9A P51151 1/20 0.42
HTR2A P28223 1/20 0.41

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
SCHEMBL1672674 0.75 IDO1 (0.78) IDO1KDM4EGAAALDH1A1TTK
SCHEMBL1754216 0.72 IDO1 (0.56) IDO1KDM4EGAAALDH1A1TTK
SCHEMBL855531 0.70 ALDH1A1 (1.00) IDO1KDM4EGAAALDH1A1TTK
SCHEMBL30768403 0.70 ALDH1A1 (1.00) IDO1KDM4EGAAALDH1A1TTK
SCHEMBL2969026 0.69 ESR1 (0.41) IDO1KDM4EGAAALDH1A1TTK
SCHEMBL17610247 0.68 IDO1 (0.60) IDO1KDM4EGAAALDH1A1TTK
SCHEMBL16937122 0.68 IDO1 (0.71) IDO1KDM4EGAAALDH1A1TTK
SCHEMBL17178615 0.67 ALDH1A1 (0.92) IDO1KDM4EGAAALDH1A1TTK
SCHEMBL7619575 0.67 ITK (0.51) IDO1KDM4EGAAALDH1A1TTK
SCHEMBL10533662 0.66 IDO1 (0.74) IDO1KDM4EGAAALDH1A1TTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4398911-A2 INK4 TUMOR SUPPRESSOR PROTEINS MEDIATE RESISTANCE TO CDK4/6 KINASE INHIBITORS Memorial Sloan Kettering Cancer Center (US) 2024-07-17 EP disclosed
WO-2024123818-A1 FUNCTIONALIZED COLLOIDAL SILICA AND METHODS OF PRODUCTION W.R. GRACE & CO.-CONN (US) 2024-06-13 WO disclosed
EP-4370701-A1 TEXTILES DERIVED FROM FOOD WASTE AND PROCESSES OF MAKING THEREOF Alt Tex Inc. (CA) 2024-05-22 EP disclosed
WO-2024102441-A1 PROCESSING AID FORMULATION AND POLYOLEFIN FILMS MADE THEREFROM Amcor Flexibles North America, Inc. (US) 2024-05-16 WO disclosed
WO-2024097945-A1 PRODRUGS FOR MITOCHONDRIAL CALCIUM UPTAKE INHIBITORS CORNELL UNIVERSITY (US) 2024-05-10 WO disclosed
WO-2024077087-A2 M24B AMINOPEPTIDASE INHIBITORS FOR CARDS INFLAMMASOME ACTIVATION MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2024-04-11 WO disclosed
US-20240100191-A1 METHODS AND COMPOSITIONS FOR MODULATING GENE EXPRESSION WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2024-03-28 US disclosed
WO-2024015641-A1 SMALL MOLECULE FOR TREATMENT OF CANCER OF THE APPENDIX THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2024-01-18 WO disclosed
EP-4304594-A1 HYDROXYQUINOLINE COMPOUNDS AND METHODS OF USE AS PIGMENT MODIFYING AGENTS Germanas, Juris (US) 2024-01-17 EP disclosed
WO-2024006287-A2 ANTIVIRAL COMPOUNDS USEFUL AGAINST SARS-COV-2 UNIVERSITY OF KANSAS (US) 2024-01-04 WO disclosed
WO-2009070420-A1 METAL ALKOXIDES, APPARATUS FOR MANUFACTURING METAL ALKOXIDES, RELATED METHODS AND USES THEREOF APPLIED NANOWORKS, INC. (US) 2009-06-04 WO disclosed
WO-2009058377-A1 LIGANDS SPECIFIC FOR CANNABINOID RECEPTOR SUBTYPE 2 UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2009-05-07 WO disclosed
EP-2035005-A2 THERAPY USING CYTOKINE INHIBITORS Kemia, INC. (US) 2009-03-18 EP disclosed
WO-2009002873-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR REDUCING LIPID LEVELS CVI PHARMACEUTICALS LIMITED (KY) 2008-12-31 WO disclosed
WO-2008153633-A2 PRODUCT CONTAINING MONOMER AND POLYMERS OF TITANYLS AND METHODS FOR MAKING SAME APPLIED NANO WORKS, INC. (US) 2008-12-18 WO disclosed
WO-2008124072-A1 PALMEROLIDES: METHODS OF PREPARATION AND DERIVATIVES THEREOF THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2008-10-16 WO disclosed
WO-2007146712-A2 THERAPY USING CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-12-21 WO disclosed
WO-2007075896-A2 HETEROCYCLIC CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-07-05 WO disclosed
WO-2007058990-A2 THERAPY USING CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-05-24 WO disclosed
WO-2007056016-A2 BISAMIDE CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-05-18 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 (1 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-20240100191-A1 METHODS AND COMPOSITIONS FOR MODULATING GENE EXPRESSION BRD4, BICRA, BRDT IDO1 3988/4885KDM4E 924/4885GAA 4285/4885

“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.