SCHEMBL22453041

SCHEMBL22453041

CN(c1ccc(N2CC(Oc3ccc(C45CC6CC7CC(C4)C75C6)cc3)C2)cc1)c1ccccc1C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 1/20 0.35
▸ ACACB O00763 16/20 0.34
▸ FFAR4 Q5NUL3 2/20 0.34
▸ GFER P55789 1/20 0.33

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
SCHEMBL22452504 0.84 HIF1A (0.43) NAMPTACACBFFAR4GFER
SCHEMBL22453367 0.76 ACACB (0.38) NAMPTACACB
SCHEMBL22452465 0.68 KDM4C (0.39) GFER
SCHEMBL22453037 0.68 HIF1A (0.50) —
SCHEMBL22453056 0.68 KDM4C (0.37) GFER
SCHEMBL22452516 0.66 HIF1A (0.47) —
SCHEMBL22452491 0.66 HIF1A (0.42) —
SCHEMBL22452819 0.64 HIF1A (0.41) —
SCHEMBL28673995 0.64 LMNA (0.57) —
SCHEMBL29698736 0.64 LMNA (0.57) —

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-2020190774-A1 NOVEL SMALL MOLECULE INHIBITORS OF TEAD TRANSCRIPTION FACTORS THE GENERAL HOSPITAL CORPORATION (US) 2020-09-24 — — WO disclosed
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