SCHEMBL31565713

SCHEMBL31565713

O=C(CC(=O)c1ccc(CS)cc1)OC(=O)CC(=O)c1ccc(CS)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 1/20 0.39
▸ HDAC4 P56524 1/20 0.39
▸ HDAC1 Q13547 1/20 0.39
▸ HDAC7 Q8WUI4 1/20 0.39
▸ HDAC2 Q92769 1/20 0.39
▸ HDAC10 Q969S8 1/20 0.39
▸ HDAC11 Q96DB2 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ HDAC9 Q9UKV0 1/20 0.39
▸ HDAC5 Q9UQL6 1/20 0.39
▸ KMT2A Q03164 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ CES1 P23141 1/20 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
SCHEMBL9352248 0.80 KMT2A (0.46) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL306422 0.78 MAPT (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL3252460 0.75 KMT2A (0.70) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL6631999 0.74 GSK3B (0.59) CES1IDO1FOLH1
SCHEMBL2732308 0.72 LOXL2 (0.66) KMT2AMEN1MAPTSMN1; SMN2KDM4E
SCHEMBL14234617 0.72 CES2 (0.50) KMT2ACES1IDO1FOLH1
SCHEMBL1200737 0.72 SRD5A2 (0.48) KMT2AMAPTHPGDIDO1FOLH1
SCHEMBL16174705 0.72 ALDH1A1 (0.42) KMT2AMEN1MAPTSMN1; SMN2CYP3A4
SCHEMBL11007778 0.71 IDO1 (0.41) KMT2AMAPTSMN1; SMN2KDM4EMAPK1
SCHEMBL315781 0.70 ALDH1A1 (0.60) KMT2AMEN1MAPTSMN1; SMN2KDM4E

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
CN-119950826-A Preparation method of anticoagulation coating and medical instrument 通桥医疗科技(苏州)有限公司 2025-05-09 — — CN disclosed
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