SCHEMBL23464592

SCHEMBL23464592

Cc1ccc(/C=C/C(=O)NC23CCC4C(C(=O)C=C5C6(C)C=C(C#N)C(=O)C(C)C6CCC54C)C2CC(C)(C)CC3)cc1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 3/20 0.36
▸ MBOAT4 Q96T53 4/20 0.35
▸ USP2 O75604 1/20 0.35
▸ STAT3 P40763 1/20 0.35
▸ NFE2L2 Q16236 1/20 0.35
▸ USP7 Q93009 1/20 0.35
▸ NOS2 P35228 12/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ KEAP1 Q14145 1/20 0.35
▸ CCR6 P51684 1/20 0.31

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
SCHEMBL23465344 0.92 MBOAT4 (0.36) RORCMBOAT4USP2STAT3NFE2L2
SCHEMBL23465022 0.88 RORC (0.34) RORCMBOAT4USP2STAT3NFE2L2
SCHEMBL23098226 0.84 MBOAT4 (0.41) RORCMBOAT4USP2STAT3NFE2L2
SCHEMBL22875560 0.82 MBOAT4 (0.39) RORCMBOAT4USP2STAT3NFE2L2
SCHEMBL21022599 0.82 MBOAT4 (0.39) RORCMBOAT4USP2STAT3NFE2L2
SCHEMBL22875356 0.82 MBOAT4 (0.39) RORCMBOAT4USP2STAT3NFE2L2
SCHEMBL23464801 0.81 RORC (0.37) RORCMBOAT4USP2STAT3NFE2L2
SCHEMBL23465024 0.81 MBOAT4 (0.47) RORCMBOAT4USP2STAT3NFE2L2
SCHEMBL20826204 0.78 NOS2 (0.39) RORCMBOAT4USP2STAT3NFE2L2
SCHEMBL22875550 0.77 MBOAT4 (0.37) RORCMBOAT4USP2STAT3NFE2L2

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-2021104391-A1 OLEANANE CINNAMAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF 鲁南制药集团股份有限公司 2021-06-03 — — WO disclosed
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