SCHEMBL6764388

SCHEMBL6764388

Cc1nnc(-c2ccc3ncnc(Nc4ccc(Oc5ccccc5)cc4)c3c2)o1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 1/20 0.58
TEK Q02763 1/20 0.58
EGFR P00533 5/20 0.56
RIPK2 O43353 1/20 0.56
EPHB2 P29323 1/20 0.56
USP2 O75604 5/20 0.55
CYP1A2 P05177 5/20 0.55
CYP3A4 P08684 5/20 0.55
LMNA P02545 4/20 0.55
CLK4 Q9HAZ1 4/20 0.55
TSHR P16473 4/20 0.55
BRAF P15056 4/20 0.55
CYP2C19 P33261 3/20 0.55
CYP2C9 P11712 3/20 0.55
MAPK1 P28482 3/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
HSD17B10 Q99714 2/20 0.55
ERBB2 P04626 2/20 0.52
ALDH1A1 P00352 3/20 0.51

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
Hydrochloric Acid SCHEMBL6766661 0.99 KDR (0.57) KDRTEKEGFRRIPK2EPHB2
SCHEMBL6767208 0.88 EGFR (0.66) EGFRCLK4ERBB2PIK3CAPIK3CG
Hydrochloric Acid SCHEMBL6766892 0.88 EGFR (0.64) EGFRCLK4ERBB2PIK3CAPIK3CG
SCHEMBL7010037 0.85 EGFR (0.55) KDRTEKEGFRRIPK2EPHB2
SCHEMBL6773317 0.84 BRAF (0.53) EGFRUSP2CYP1A2CYP3A4LMNA
SCHEMBL6767372 0.83 EGFR (0.49) EGFRUSP2CYP1A2CYP3A4LMNA
Hydrochloric Acid SCHEMBL6768785 0.83 BRAF (0.52) EGFRUSP2CYP1A2CYP3A4LMNA
Hydrochloric Acid SCHEMBL6768063 0.82 EGFR (0.48) EGFRUSP2CYP1A2CYP3A4LMNA
SCHEMBL6767609 0.81 EGFR (0.53) KDREGFRUSP2CYP1A2CYP3A4
Hydrochloric Acid SCHEMBL6766522 0.80 EGFR (0.52) KDREGFRUSP2CYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6391874-B1 ANTICARCINOGENIC AGENTS; SKIN DISORDERS SMITHKLINE BEECHAM CORPORATION 2002-05-21 US claimed
US-6828320-B2 Enzyme inhibitors; anticancer agents SMITHKLINE BEECHAM CORPORATION 2004-12-07 US disclosed
US-20020147214-A1 Heterocyclic compounds NOVARTIS AG (CH) 2002-10-10 US disclosed
US-6391874-B1 ANTICARCINOGENIC AGENTS; SKIN DISORDERS SMITHKLINE BEECHAM CORPORATION 2002-05-21 US disclosed
EP-0912559-A1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1999-05-06 EP disclosed
WO-1998002434-A1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1998-01-22 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-20020147214-A1 Heterocyclic compounds BRAF, ABL1, CSK KDR 700/4885TEK 1238/4885EGFR 354/4885

“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.