SCHEMBL31411772

SCHEMBL31411772

O=C(O)c1ccc2c(c1)N(CC1CC1)C(=O)CS2

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.60
▸ ALDH1A1 P00352 6/20 0.55
▸ USP2 O75604 1/20 0.55
▸ TSHR P16473 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ NPC1 O15118 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ CYP2C9 P11712 2/20 0.47
▸ CYP2C19 P33261 2/20 0.47
▸ POLB P06746 3/20 0.46
▸ MAPT P10636 3/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ CYP3A4 P08684 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
SCHEMBL31411647 0.90 LMNA (0.50) LMNAALDH1A1USP2TSHRNPSR1
SCHEMBL31411699 0.85 POLB (0.65) LMNAALDH1A1USP2TSHRNPSR1
SCHEMBL31411660 0.85 LMNA (0.52) LMNAALDH1A1USP2TSHRNPSR1
SCHEMBL10022667 0.83 LMNA (0.68) LMNAALDH1A1USP2TSHRNPSR1
SCHEMBL25920681 0.81 LMNA (0.69) LMNAALDH1A1USP2TSHRNPSR1
SCHEMBL23768992 0.80 ALDH1A1 (0.71) LMNAALDH1A1NPSR1NPC1CYP2C9
SCHEMBL29978848 0.80 ALDH1A1 (0.71) LMNAALDH1A1NPSR1NPC1CYP2C9
SCHEMBL25920685 0.79 LMNA (0.66) LMNAALDH1A1USP2TSHRNPSR1
SCHEMBL31411722 0.76 POLB (0.55) LMNAALDH1A1USP2TSHRNPSR1
SCHEMBL31411550 0.76 LMNA (0.58) LMNAALDH1A1NPSR1NPC1L3MBTL1

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-119330982-A Azetidine compound and medical application thereof 中国科学院上海药物研究所 2025-01-21 — — CN disclosed
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