SCHEMBL9525846

SCHEMBL9525846

O=C1Cc2ccccc2N1c1nccs1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.53
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 4/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
POLB P06746 1/20 0.42
APEX1 P27695 1/20 0.42
RECQL P46063 1/20 0.42
GAA P10253 3/20 0.41
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
G6PD P11413 1/20 0.41
PKM P14618 1/20 0.41
MPI P34949 1/20 0.41
EP300 Q09472 1/20 0.41
KAT2A Q92830 1/20 0.41
KAT2B Q92831 1/20 0.41
NOTUM Q6P988 1/20 0.40
CASP3 P42574 2/20 0.39
CASP6 P55212 2/20 0.39

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
SCHEMBL27693209 0.81 HSD17B10 (0.39) HPGDHSD17B10TDP1L3MBTL1POLB
SCHEMBL2340654 0.73 HPGD (0.57) HPGDTDP1POLBGAAALDH1A1
SCHEMBL29150182 0.71 TDP1 (0.53) HPGDHSD17B10TDP1L3MBTL1POLB
SCHEMBL693321 0.71 SLC11A2 (0.38) HSD17B10TDP1L3MBTL1GAAALDH1A1
SCHEMBL28199867 0.71 HSD17B10 (0.56) HSD17B10TDP1L3MBTL1POLBAPEX1
SCHEMBL30486192 0.70 HSD17B10 (0.73) HSD17B10TDP1L3MBTL1POLBAPEX1
SCHEMBL29204149 0.70 HSD17B10 (0.73) HSD17B10TDP1L3MBTL1POLBAPEX1
SCHEMBL9959877 0.70 HPGD (0.57) HPGDTDP1GAAMAPTPKM
SCHEMBL1459655 0.70 HPGD (0.53) HPGDTDP1GAAALDH1A1MAPT
SCHEMBL27481595 0.70 HPGD (0.53) HPGDTDP1L3MBTL1POLBGAA

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
EP-0378358-B1 Anti-inflammmatory 1-heteroaryl-3-acyl-2-oxindoles PFIZER (US) 1993-11-03 EP disclosed
US-5116854-A Enzyme inhibitors PFIZER INC. (US) 1992-05-26 US disclosed
WO-1990008145-A1 ANTI-INFLAMMATORY 1-HETEROARYL-3-ACYL-2-OXINDOLES PFIZER INC. (US) 1990-07-26 WO disclosed
EP-0378358-A1 Anti-inflammmatory 1-heteroaryl-3-acyl-2-oxindoles PFIZER INC. (US) 1990-07-18 EP disclosed