SCHEMBL7478091

SCHEMBL7478091

Cc1cc2nc(C(NC(=O)O)C(C)(C)C)[nH]c2cc1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.46
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44
TUBB3 Q13509 1/20 0.44
TUBB2A Q13885 1/20 0.44
TUBB8 Q3ZCM7 1/20 0.44
TUBA3E Q6PEY2 1/20 0.44
TUBA1A Q71U36 1/20 0.44
TUBA1C Q9BQE3 1/20 0.44
TUBB6 Q9BUF5 1/20 0.44
TUBB2B Q9BVA1 1/20 0.44
TUBB1 Q9H4B7 1/20 0.44
EGLN1 Q9GZT9 1/20 0.42
HPSE Q9Y251 1/20 0.41
FABP6 P51161 1/20 0.41
KMT2A Q03164 3/20 0.40

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
SCHEMBL16516059 0.82 AAK1 (0.48) EGLN1MAPTKDM4EMMP2
SCHEMBL2038892 0.81 KMT2A (0.58) KMT2A
SCHEMBL5129452 0.80 KMT2A (0.39) HSD17B10KMT2AF9
SCHEMBL5126955 0.80 KMT2A (0.39) KMT2A
SCHEMBL2040504 0.77 PDE2A (0.48) KMT2A
SCHEMBL16515607 0.75 SCN10A (0.36) KMT2AKDM4E
Lithium Ion SCHEMBL31716345 0.73 HSD17B10 (0.47) HSD17B10TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5382763 0.73 TUBB4A (0.48) HSD17B10TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL6511841 0.71 CYP1A2 (0.65) HSD17B10TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL12335533 0.71 CYP1A2 (0.65) HSD17B10TUBB4ATUBBTUBA3CTUBA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1171435-A2 PYRIMIDINE-2-ONE DERIVATIVES AS INTEGRIN RECEPTOR LIGANDS BASF AKTIENGESELLSCHAFT (DE) 2002-01-16 EP disclosed
WO-2000061551-A2 PYRIMIDINE-2-ONE DERIVATIVES AS INTEGRIN RECEPTOR LIGANDS BASF AKTIENGESELLSCHAFT (DE) 2000-10-19 WO disclosed