SCHEMBL31374883

SCHEMBL31374883

N#Cc1cc2c(cc1F)SCCC(=O)N2

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC8 Q9BY41 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ TP53 P04637 1/20 0.38
▸ LMNA P02545 4/20 0.37
▸ KMT2A Q03164 3/20 0.36
▸ MAPT P10636 1/20 0.35
▸ PTP4A3 O75365 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ TRPV4 Q9HBA0 2/20 0.34
▸ PGR P06401 1/20 0.32
▸ AR P10275 1/20 0.32
▸ MAOA P21397 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ HTT P42858 1/20 0.30

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
SCHEMBL30675699 0.77 HDAC1 (0.46) HDAC1HDAC8HDAC6TP53LMNA
SCHEMBL30675667 0.77 HDAC1 (0.49) HDAC1HDAC8HDAC6TP53LMNA
SCHEMBL31374905 0.75 HDAC1 (0.53) HDAC1HDAC8HDAC6TP53LMNA
SCHEMBL30675683 0.72 HDAC1 (0.42) HDAC1HDAC8HDAC6TP53LMNA
SCHEMBL5507140 0.72 HDAC1 (0.57) HDAC1HDAC8HDAC6TP53LMNA
SCHEMBL30675755 0.70 HDAC1 (0.51) HDAC1HDAC8HDAC6TP53LMNA
SCHEMBL8853758 0.69 LMNA (0.54) HDAC1HDAC8HDAC6TP53LMNA
SCHEMBL30675680 0.69 PLAT (0.36) HDAC1HDAC8HDAC6TP53LMNA
SCHEMBL8853550 0.69 HDAC1 (0.57) HDAC1HDAC8HDAC6TP53LMNA
SCHEMBL474617 0.69 NR3C2 (0.51) TP53KMT2AMAPTTHRBPGR

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
CN-119698413-A Bicyclic tetrahydrothiazepine derivatives 豪夫迈·罗氏有限公司 2025-03-25 — — CN disclosed
CN-119677733-A Bicyclic tetrahydrothiazepine derivatives 豪夫迈·罗氏有限公司 2025-03-21 — — CN disclosed
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