SCHEMBL5897147

SCHEMBL5897147

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.48
FABP6 P51161 1/20 0.46
ATM Q13315 3/20 0.45
MAPT P10636 3/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 1/20 0.45
CACNA1B Q00975 1/20 0.45
APBA1 Q02410 1/20 0.45
MCL1 Q07820 1/20 0.45
EGLN1 Q9GZT9 1/20 0.44
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43
TUBB2A Q13885 1/20 0.43
TUBB8 Q3ZCM7 1/20 0.43

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
SCHEMBL11436852 0.81 PIN1 (0.59) HSD17B10KMT2AKDM4ETUBB4ATUBB
SCHEMBL544668 0.78 SMAD3 (0.41) ERAP1AMY1A
SCHEMBL855805 0.76 MCHR1 (0.33) TDP1
SCHEMBL251109 0.75 LMNA (0.53) HSD17B10MAPTKMT2AKDM4ETDP1
SCHEMBL11839896 0.74 MEN1 (0.37) MAPTMEN1KMT2AMCL1NPC1
SCHEMBL11096785 0.74 TDP1 (0.35) MAPTKMT2AKDM4EMMP2TDP1
SCHEMBL830501 0.73 KDM4E (0.34) HSD17B10MAPTMEN1KMT2AKDM4E
SCHEMBL3388847 0.73 ALDH1A1 (0.65) FABP6MEN1KMT2AKDM4ERAB9A
SCHEMBL4279399 0.73 HPGD (0.51) FABP6MEN1KMT2AKDM4ENPC1
SCHEMBL11217318 0.73 PIN1 (0.65) HSD17B10FABP6ATMMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7125883-B1 Integrin receptor ligands ABBOTT GMBH & CO. KG (DE) 2006-10-24 US disclosed