SCHEMBL27475261

SCHEMBL27475261

CCOC(=O)c1nc(-c2ccccc2)[nH]c1C

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 7/20 0.68
HSD17B10 Q99714 3/20 0.60
KDM4E B2RXH2 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
TP53 P04637 1/20 0.60
TARBP2 Q15633 1/20 0.52
MAPK1 P28482 2/20 0.52
SLC9A1 P19634 1/20 0.52
USP2 O75604 1/20 0.52
TSHR P16473 1/20 0.52
ALDH1A1 P00352 2/20 0.51
HPGD P15428 2/20 0.51
MAPT P10636 2/20 0.51
NPC1 O15118 1/20 0.51
LMNA P02545 1/20 0.51
GAA P10253 1/20 0.51
RAB9A P51151 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
ERCC1 P07992 1/20 0.50
FEN1 P39748 1/20 0.50

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
SCHEMBL28582964 0.87 TARBP2 (0.54) PIN1HSD17B10KDM4ESMN1; SMN2TARBP2
SCHEMBL6520020 0.86 PIN1 (0.52) PIN1HSD17B10KDM4ESMN1; SMN2TP53
SCHEMBL21374324 0.86 PIN1 (0.52) PIN1HSD17B10KDM4ESMN1; SMN2TP53
SCHEMBL28297325 0.85 KDM4E (0.60) PIN1HSD17B10KDM4ESMN1; SMN2TP53
SCHEMBL11564100 0.84 PIN1 (0.81) PIN1HSD17B10MAPK1SLC9A1MAPT
SCHEMBL15592594 0.82 HSD17B10 (0.56) PIN1HSD17B10KDM4ESMN1; SMN2TARBP2
SCHEMBL28575489 0.82 DGAT1 (0.49) PIN1HSD17B10KDM4ESMN1; SMN2TP53
SCHEMBL17803252 0.82 KDM4E (0.58) PIN1HSD17B10KDM4ESMN1; SMN2TP53
SCHEMBL4382123 0.81 KDM4E (0.57) PIN1HSD17B10KDM4ESMN1; SMN2TP53
SCHEMBL316552 0.81 PIN1 (1.00) PIN1KDM4EMAPK1SLC9A1ALDH1A1

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
CN-1177848-C Bicyclic heteroaromatic compounds useful as LH agonists ��˹��ŵ�� 2004-12-01 CN disclosed
CN-1349535-A Bicyclic heteroaromatic compounds useful as LH agonists AKZO NOBEL NV (NL) 2002-05-15 CN disclosed