SCHEMBL30994238

SCHEMBL30994238

COCOc1cc(C(F)(F)F)cc(C)c1-c1cc2cccc(O)c2nn1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ IL1B P01584 18/20 0.41
▸ TNF P01375 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ NLRP3 Q96P20 2/20 0.34

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
SCHEMBL30994100 0.84 CTSA (0.33) IL1B
SCHEMBL30994333 0.84 IL1B (0.32) IL1B
SCHEMBL30994250 0.79 IL1B (0.39) IL1BTNFNLRP3
SCHEMBL30994027 0.76 PROKR1 (0.39) IL1BNLRP3
SCHEMBL30994253 0.74 IL1B (0.43) IL1BTNFNLRP3
SCHEMBL30994382 0.73 BRD4 (0.33) IL1B
SCHEMBL30973598 0.73 IL1B (0.34) IL1BTNF
SCHEMBL30994247 0.72 IL1B (0.35) IL1BTNF
SCHEMBL30994118 0.72 IL1B (0.32) IL1B
SCHEMBL30994319 0.71 PDE2A (0.32) IL1B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4656635-A1 SUBSTITUTED BENZENE COMPOUND Daiichi Sankyo Company, Limited (JP) 2025-12-03 — — EP disclosed
WO-2024157953-A1 SUBSTITUTED BENZENE COMPOUND 第一三共株式会社 2024-08-02 — — WO disclosed
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