SCHEMBL29947458

SCHEMBL29947458

Cc1ccc(C(=O)Nc2nc3ccc(C(=O)O)cc3s2)cc1Cl

nearest known ligand 0.77

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.77
MEN1 O00255 1/20 0.58
POLB P06746 1/20 0.58
KMT2A Q03164 1/20 0.58
RXFP1 Q9HBX9 1/20 0.58
LCK P06239 7/20 0.58
SMN1; SMN2 Q16637 2/20 0.56
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
HPGD P15428 1/20 0.56
KLK7 P49862 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
FYN P06241 1/20 0.56
SRC P12931 1/20 0.56
HTT P42858 1/20 0.55

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
SCHEMBL24729471 1.00 HSD17B10 (0.77) HSD17B10MEN1POLBKMT2ARXFP1
SCHEMBL24729232 0.89 HSD17B10 (0.82) HSD17B10MEN1KMT2ARXFP1SMN1; SMN2
SCHEMBL29947688 0.86 HSD17B10 (0.77) HSD17B10MEN1KMT2ARXFP1SMN1; SMN2
SCHEMBL29947487 0.86 HSD17B10 (0.64) HSD17B10MEN1POLBKMT2ARXFP1
SCHEMBL24729258 0.86 HSD17B10 (0.77) HSD17B10MEN1KMT2ARXFP1SMN1; SMN2
SCHEMBL24729308 0.86 HSD17B10 (0.64) HSD17B10MEN1POLBKMT2ARXFP1
SCHEMBL29947383 0.85 HSD17B10 (0.72) HSD17B10MEN1KMT2ARXFP1SMN1; SMN2
SCHEMBL24729517 0.85 HSD17B10 (0.72) HSD17B10MEN1KMT2ARXFP1SMN1; SMN2
SCHEMBL24729511 0.85 HSD17B10 (0.62) HSD17B10MEN1POLBKMT2ARXFP1
SCHEMBL29947706 0.85 HSD17B10 (0.62) HSD17B10MEN1POLBKMT2ARXFP1

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
WO-2022240213-A1 NOVEL BENZOTHIAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF FOR PREVENTION OR TREATMENT OF LIVER DISEASE 에이치케이이노엔 주식회사 2022-11-17 WO claimed
WO-2022240213-A1 NOVEL BENZOTHIAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF FOR PREVENTION OR TREATMENT OF LIVER DISEASE 에이치케이이노엔 주식회사 2022-11-17 WO disclosed