SCHEMBL5458537

SCHEMBL5458537

CSc1ncc2cc(C(C)=O)c(=O)[nH]c2n1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ AHR P35869 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ KDM6B O15054 1/20 0.40
▸ KDM4A O75164 1/20 0.40
▸ KDM4D Q6B0I6 1/20 0.40
▸ HIF1AN Q9NWT6 1/20 0.40
▸ KDM2A Q9Y2K7 1/20 0.40
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ PDE4B Q07343 1/20 0.37
▸ DYRK1A Q13627 5/20 0.37
▸ DYRK1B Q9Y463 5/20 0.37
▸ POLB P06746 2/20 0.36
▸ THRB P10828 1/20 0.36
▸ GAA P10253 1/20 0.35

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
SCHEMBL10323760 0.89 KDM6B (0.50) NPC1RAB9AAHRALDH1A1KDM6B
SCHEMBL10323979 0.86 DYRK1A (0.45) AHRALDH1A1KDM6BKDM4AKDM4D
SCHEMBL5458213 0.84 KDM6B (0.37) NPC1RAB9AAHRKDM6BKDM4A
SCHEMBL20589469 0.82 SYK (0.52) ALDH1A1MEN1KMT2APOLBGAA
SCHEMBL5262113 0.79 MEN1 (0.39) NPC1RAB9AAHRMEN1KMT2A
SCHEMBL6073419 0.78 MEN1 (0.43) NPC1AHRALDH1A1MEN1KMT2A
SCHEMBL13345301 0.78 MEN1 (0.38) NPC1RAB9AAHRALDH1A1KDM6B
SCHEMBL661610 0.78 MEN1 (0.38) NPC1RAB9AAHRALDH1A1MEN1
SCHEMBL29538008 0.78 MEN1 (0.38) NPC1RAB9AAHRALDH1A1MEN1
SCHEMBL31637509 0.78 MEN1 (0.43) NPC1AHRALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070032518-A1 Compounds and methods of use AMGEN INC. (US) 2007-02-08 — — US disclosed
EP-1478645-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS Amgen Inc. (US) 2004-11-24 — — EP disclosed
US-6822097-B1 THIAZOLE-SUBSTITUTED QUINOLINE DERIVATIVES; ANTICARCINOGENIC AGENTS, ANTISTROKE AGENTS; APOPTOSIS AND CELL PROLIFERATION TREATMENT; NERVOUS SYSTEM DISORDERS AMGEN, INC. 2004-11-23 — — US disclosed
WO-2003066630-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS AMGEN INC. (US) 2003-08-14 — — 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-20070032518-A1 Compounds and methods of use BAX, BAD, CASP3 NPC1 69/4885RAB9A 2403/4885AHR 1756/4885

“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.

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