SCHEMBL31504349

SCHEMBL31504349

Cc1cc(OCc2ccccn2)ccc1Nc1cccc(C(=O)NCCCC(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.47
▸ SMO Q99835 7/20 0.45
▸ MAPK14 Q16539 5/20 0.45
▸ GPR132 Q9UNW8 1/20 0.43
▸ PAX8 Q06710 1/20 0.41
▸ KCNH2 Q12809 2/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ NR1H4 Q96RI1 1/20 0.40

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
SCHEMBL21617238 1.00 BRD4 (0.47) BRD4SMOMAPK14GPR132PAX8
SCHEMBL21617162 0.95 SMO (0.46) BRD4SMOMAPK14GPR132KCNH2
SCHEMBL31504407 0.95 SMO (0.46) BRD4SMOMAPK14GPR132KCNH2
SCHEMBL21617209 0.90 BRD4 (0.49) BRD4SMOMAPK14GPR132NR1H4
SCHEMBL21617180 0.86 NPC1 (0.43) PAX8NR1H4
SCHEMBL31504444 0.85 BRD4 (0.44) BRD4SMOMAPK14GPR132NR1H4
SCHEMBL21617269 0.85 BRD4 (0.44) BRD4SMOMAPK14GPR132NR1H4
SCHEMBL31504320 0.85 SMO (0.46) BRD4SMOMAPK14GPR132KCNH2
SCHEMBL21617198 0.85 SMO (0.46) BRD4SMOMAPK14GPR132KCNH2
SCHEMBL21617187 0.84 MAPK14 (0.44) BRD4SMOMAPK14GPR132

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-112638877-B Phenyl/pyridinyl-N-phenyl/pyridinyl derivatives for the treatment of RNA viral infections ABIVAX公司 2025-04-22 — — CN disclosed
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