SCHEMBL24879916

SCHEMBL24879916

CC1(C)OB(c2cccnc2Nc2ccc(C(F)(F)F)cc2)OC1(C)C

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 6/20 0.49
▸ LIPE Q05469 4/20 0.44
▸ TRPV1 Q8NER1 8/20 0.41
▸ DHODH Q02127 1/20 0.39

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
SCHEMBL22585908 0.84 DHODH (0.44) DHODH
SCHEMBL25955371 0.82 EGFR (0.35) DHODH
SCHEMBL25431556 0.82 PIP4K2A (0.40) EPHX2DHODH
SCHEMBL20552809 0.79 LIPE (0.52) EPHX2LIPETRPV1
SCHEMBL30544066 0.79 LIPE (0.52) EPHX2LIPETRPV1
SCHEMBL25426624 0.77 LIPE (0.55) LIPE
SCHEMBL25042801 0.76 LIPE (0.46) EPHX2LIPE
SCHEMBL26674609 0.75 LIPE (0.36) LIPEDHODH
SCHEMBL30641310 0.75 LIPE (0.36) LIPEDHODH
SCHEMBL16967950 0.75 LPL (0.35) LIPE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115594680-A TEAD inhibitor 武汉人福创新药物研发中心有限公司(CN) 2023-01-13 — — CN disclosed
WO-2023280254-A1 TEAD INHIBITOR 武汉人福创新药物研发中心有限公司 2023-01-12 — — WO disclosed
WO-2023280254-A1 TEAD INHIBITOR 武汉人福创新药物研发中心有限公司 2023-01-12 — — WO disclosed
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