SCHEMBL28915335

SCHEMBL28915335

CC1CCC(NC(=O)c2cc3ccc(NC(=O)O)cc3n2Cc2ccc(C(=O)N(C)C)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 7/20 0.43
▸ CNR1 P21554 3/20 0.43
▸ CNR2 P34972 3/20 0.43
▸ NPC1 O15118 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ ECE1 P42892 1/20 0.39
▸ RHEB Q15382 3/20 0.39
▸ F2 P00734 2/20 0.37
▸ DRD4 P21917 1/20 0.37
▸ BRD4 O60885 1/20 0.37
▸ PRSS1 P07477 1/20 0.37
▸ P2RX3 P56373 1/20 0.37

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
SCHEMBL28594051 0.92 F10 (0.47) F10CNR1CNR2NPC1MEN1
SCHEMBL28582805 0.90 F10 (0.45) F10CNR1CNR2NPC1MEN1
SCHEMBL28575354 0.88 CNR1 (0.43) F10CNR1CNR2NPC1MEN1
SCHEMBL21822341 0.85 F10 (0.49) F10CNR1CNR2NPC1MEN1
SCHEMBL21822432 0.85 F10 (0.42) F10CNR1CNR2NPC1MEN1
SCHEMBL21822242 0.84 CCR9 (0.48) F10CNR1CNR2NPC1MEN1
SCHEMBL28961405 0.82 SMYD3 (0.46) F10F2
SCHEMBL28961404 0.82 SMYD3 (0.46) F10F2
SCHEMBL28575297 0.81 SMYD3 (0.45) F10F2PRSS1
SCHEMBL28575296 0.81 SMYD3 (0.45) F10F2PRSS1

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-112996529-A Matriptase 2 inhibitor and application thereof 迪斯克医药公司 2021-06-18 — — CN disclosed
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