SCHEMBL31708217

SCHEMBL31708217

O=Cc1ccc(SC2CCOC2=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.44
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 7/20 0.42
MAPK1 P28482 4/20 0.42
POLB P06746 2/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.42
CYP2C19 P33261 3/20 0.40
CYP1A2 P05177 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
HPGD P15428 2/20 0.40
TP53 P04637 1/20 0.40
PKM P14618 1/20 0.40
PPARG P37231 1/20 0.40
NCOA2 Q15596 1/20 0.40
CYP3A4 P08684 1/20 0.40
PRNP P04156 1/20 0.39
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38

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
SCHEMBL5569137 0.86 KMT2A (0.42) HSD17B10KMT2AALDH1A1MAPK1POLB
SCHEMBL873535 0.80 DDB1 (0.51) HSD17B10KMT2AALDH1A1MAPK1POLB
SCHEMBL15746491 0.80 DDB1 (0.51) HSD17B10KMT2AALDH1A1MAPK1POLB
SCHEMBL877603 0.80 POLB (0.53) HSD17B10KMT2AALDH1A1MAPK1POLB
SCHEMBL4501819 0.80 KMT2A (0.44) HSD17B10KMT2AALDH1A1MAPK1POLB
SCHEMBL4491902 0.80 KMT2A (0.44) HSD17B10KMT2AALDH1A1MAPK1POLB
SCHEMBL875841 0.80 MAPK1 (0.58) HSD17B10KMT2AALDH1A1MAPK1POLB
SCHEMBL7981025 0.80 MAPK1 (0.56) HSD17B10KMT2AALDH1A1MAPK1POLB
SCHEMBL31708250 0.77 HSD17B10 (0.36) HSD17B10KMT2AALDH1A1MAPK1POLB
SCHEMBL14517050 0.76 ALDH1A1 (0.56) HSD17B10KMT2AALDH1A1MAPK1POLB

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
EP-4635969-A1 NOVEL GLUCOCORTICOID, METHOD FOR PREPARING SAME, AND USE THEREOF Tianjin Pharmaceutical Biotechnology Co., Ltd. (CN) 2025-10-22 EP disclosed