SCHEMBL6767609

SCHEMBL6767609

Cc1nnc(-c2ccc3ncnc(Nc4ccc(OCc5ccc(F)cc5)cc4)c3c2)o1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.53
ERBB2 P04626 7/20 0.53
CLK4 Q9HAZ1 4/20 0.52
LMNA P02545 4/20 0.52
CYP1A2 P05177 4/20 0.52
CYP3A4 P08684 4/20 0.52
CYP2D6 P10635 4/20 0.52
CYP2C19 P33261 4/20 0.52
USP2 O75604 3/20 0.52
HIF1A Q16665 3/20 0.52
TP53 P04637 1/20 0.52
MEN1 O00255 2/20 0.50
TSHR P16473 2/20 0.50
KMT2A Q03164 2/20 0.50
ALDH1A1 P00352 1/20 0.50
RAF1 P04049 1/20 0.49
BRAF P15056 1/20 0.49
CHEK2 O96017 1/20 0.48
ROS1 P08922 1/20 0.48
FLT3 P36888 1/20 0.48

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 SCHEMBL6766522 0.99 EGFR (0.52) EGFRERBB2CLK4LMNACYP1A2
SCHEMBL6767208 0.91 EGFR (0.66) EGFRERBB2CLK4CHEK2ROS1
Hydrochloric Acid SCHEMBL6766892 0.90 EGFR (0.64) EGFRERBB2CLK4CHEK2ROS1
SCHEMBL6766849 0.88 EGFR (0.50) EGFRERBB2CLK4LMNACYP1A2
Hydrochloric Acid SCHEMBL6768794 0.87 EGFR (0.49) EGFRERBB2CLK4LMNACYP1A2
SCHEMBL6767372 0.86 EGFR (0.49) EGFRERBB2CLK4LMNACYP1A2
Hydrochloric Acid SCHEMBL6768063 0.85 EGFR (0.48) EGFRERBB2CLK4LMNACYP1A2
SCHEMBL6764388 0.81 KDR (0.58) EGFRERBB2CLK4LMNACYP1A2
SCHEMBL17055878 0.80 PIK3CG (0.70) EGFRERBB2CLK4LMNACYP1A2
Hydrochloric Acid SCHEMBL6766661 0.80 KDR (0.57) EGFRERBB2CLK4LMNACYP1A2

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 8 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
EP-0912559-A1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1999-05-06 EP claimed
WO-1998002434-A1 FUSED HETEROCYCLIC COMPOUNDS AS PROTEIN TYROSINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 1998-01-22 WO 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 EGFR 354/4885ERBB2 35/4885CLK4 266/4885

“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.