SCHEMBL31737531

SCHEMBL31737531

O=C(O)NC(C(=O)N1CCCN1c1ccccc1)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 5/20 0.37
▸ F10 P00742 5/20 0.37
▸ PRSS1 P07477 4/20 0.37
▸ HDAC4 P56524 1/20 0.36
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC7 Q8WUI4 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ HDAC8 Q9BY41 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36
▸ HDAC9 Q9UKV0 1/20 0.36
▸ HDAC5 Q9UQL6 1/20 0.36
▸ KLRK1 P26718 1/20 0.36
▸ MICA Q29983 1/20 0.36
▸ RAET1L Q5VY80 1/20 0.36
▸ EPHX2 P34913 1/20 0.36
▸ PREP P48147 1/20 0.36
▸ FAP Q12884 1/20 0.36
▸ AGTR2 P50052 1/20 0.36
▸ OPRK1 P41145 1/20 0.36
▸ KMT2A Q03164 2/20 0.35

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
SCHEMBL31738241 0.84 F2 (0.37) F2F10PRSS1HDAC4HDAC1
SCHEMBL31738025 0.83 CTSS (0.55) KCNH2
SCHEMBL31737504 0.79 PPIB (0.55) MTTP
SCHEMBL31738247 0.79 PPIB (0.55) MTTP
SCHEMBL828601 0.78 KCNH2 (0.37) F10KLRK1MICARAET1LPREP
SCHEMBL16339449 0.76 KLRK1 (0.48) F2F10PRSS1KLRK1MICA
SCHEMBL21995109 0.76 F2 (0.52) F2F10PRSS1KMT2AGAA
SCHEMBL827540 0.72 KLRK1 (0.36) F10KLRK1MICARAET1LMTTP
SCHEMBL21223444 0.71 SMN1; SMN2 (0.37) KMT2ANPC1L3MBTL1GAALMNA
Urea SCHEMBL31738035 0.70 CNR2 (0.35) KMT2A

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
WO-2025243042-A1 COMPOUNDS FOR THE INHIBITION OF CYCLOPHILIN D THE UNIVERSITY OF LIVERPOOL (GB) 2025-11-27 — — WO disclosed
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