SCHEMBL27398490

SCHEMBL27398490

Cc1ccc(C(=O)NC2COC2)nc1C

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.42
▸ SCN9A Q15858 6/20 0.42
▸ CHRM4 P08173 2/20 0.41
▸ ABL1 P00519 3/20 0.40
▸ GABRA1 P14867 2/20 0.39
▸ CNR2 P34972 1/20 0.38
▸ DPP4 P27487 1/20 0.37
▸ GRM5 P41594 1/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36

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
SCHEMBL25696639 0.89 SCN9A (0.48) SCN9ACHRM4ABL1GABRA1CNR2
SCHEMBL25696506 0.87 BRD4 (0.43) BRD4CNR2
SCHEMBL25690680 0.86 CNR2 (0.54) BRD4SCN9AGABRA1CNR2GRM5
SCHEMBL25698486 0.86 CHRM4 (0.49) CHRM4ABL1DPP4NPC1RAB9A
SCHEMBL30695535 0.82 P2RX7 (0.55) BRD4CNR2GRM5NPC1RAB9A
SCHEMBL25696652 0.76 CHRNB2 (0.48) ALDH1A1
SCHEMBL25696643 0.76 PDE7A (0.43) SCN9ACHRM4ABL1DPP4NPC1
SCHEMBL25696647 0.76 PDE7A (0.43) SCN9ACHRM4ABL1DPP4NPC1
SCHEMBL25690434 0.75 SCN9A (0.47) SCN9ACHRM4GABRA1CNR2NPC1
SCHEMBL25690685 0.75 SCN9A (0.47) SCN9ACHRM4GABRA1CNR2NPC1

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-2024050370-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF 1CBIO, INC. (US) 2024-03-07 — — WO disclosed
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