SCHEMBL23098147

SCHEMBL23098147

COC(=O)NC12CCC(C)CC1C1C(=O)C=C3C4(C)C=C(C#N)C(=O)C(C)C4CCC3(C)C1CC2

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 12/20 0.37
▸ NOS2 P35228 6/20 0.35
▸ USP2 O75604 1/20 0.33
▸ STAT3 P40763 1/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ USP7 Q93009 1/20 0.33
▸ MBOAT4 Q96T53 1/20 0.33
▸ IDH1 O75874 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
SCHEMBL23098226 0.89 MBOAT4 (0.41) RORCNOS2USP2STAT3NFE2L2
SCHEMBL21573991 0.84 RORC (0.40) RORCNOS2IDH1
SCHEMBL18973007 0.81 CYP3A4 (0.40) RORCNOS2USP2STAT3NFE2L2
SCHEMBL18972899 0.79 MBOAT4 (0.40) RORCNOS2USP2STAT3NFE2L2
SCHEMBL21022599 0.78 MBOAT4 (0.39) RORCNOS2USP2STAT3NFE2L2
SCHEMBL22875356 0.78 MBOAT4 (0.39) RORCNOS2USP2STAT3NFE2L2
SCHEMBL22875560 0.78 MBOAT4 (0.39) RORCNOS2USP2STAT3NFE2L2
SCHEMBL20826041 0.77 MBOAT4 (0.53) RORCNOS2USP2STAT3NFE2L2
SCHEMBL21022880 0.77 MBOAT4 (0.53) RORCNOS2USP2STAT3NFE2L2
SCHEMBL21085842 0.77 MBOAT4 (0.53) RORCNOS2USP2STAT3NFE2L2

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
EP-3353190-B1 C4-MODIFIED OLEANOLIC ACID DERIVATIVES FOR INHIBITION OF IL-17 AND OTHER USES REATA PHARMACEUTICALS INC (US) 2021-03-17 — — EP disclosed
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