SCHEMBL28844508

SCHEMBL28844508

Cc1coc(/C=C/c2ccc(C(F)(F)F)cc2)n1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 18/20 0.58

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
SCHEMBL28844510 1.00 ERBB2 (0.58) ERBB2
SCHEMBL27815931 0.81 ERBB2 (0.58) ERBB2
SCHEMBL6317944 0.78 SMN1; SMN2 (0.49) ERBB2
SCHEMBL6317950 0.78 SMN1; SMN2 (0.49) ERBB2
SCHEMBL4499820 0.78 ERBB2 (0.65) ERBB2
SCHEMBL3075344 0.78 ERBB2 (0.67) ERBB2
SCHEMBL3075346 0.78 ERBB2 (0.67) ERBB2
SCHEMBL4499821 0.78 ERBB2 (0.65) ERBB2
SCHEMBL5558914 0.77 ERBB2 (0.53) ERBB2
SCHEMBL5558910 0.77 ERBB2 (0.53) ERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112920133-B (E) -4-methyl-2- (4- (trifluoromethyl) styryl) oxazole compound and preparation method and application thereof 中国医科大学 2022-09-16 CN claimed
CN-112920133-A (E) -4-methyl-2- (4- (trifluoromethyl) styryl) oxazole compound and preparation method and application thereof 中国医科大学 2021-06-08 CN claimed
CN-117567485-A Pyran derivative containing fluorine and trifluoromethyl quaternary carbon center, and preparation method and application thereof 广州中医药大学(广州中医药研究院) 2024-02-20 CN disclosed
CN-112920133-B (E) -4-methyl-2- (4- (trifluoromethyl) styryl) oxazole compound and preparation method and application thereof 中国医科大学 2022-09-16 CN disclosed
CN-112920133-B (E) -4-methyl-2- (4- (trifluoromethyl) styryl) oxazole compound and preparation method and application thereof 中国医科大学 2022-09-16 CN disclosed
CN-112920133-B (E) -4-methyl-2- (4- (trifluoromethyl) styryl) oxazole compound and preparation method and application thereof 中国医科大学 2022-09-16 CN disclosed
CN-112920133-A (E) -4-methyl-2- (4- (trifluoromethyl) styryl) oxazole compound and preparation method and application thereof 中国医科大学 2021-06-08 CN disclosed
CN-112920133-A (E) -4-methyl-2- (4- (trifluoromethyl) styryl) oxazole compound and preparation method and application thereof 中国医科大学 2021-06-08 CN disclosed
CN-112920133-A (E) -4-methyl-2- (4- (trifluoromethyl) styryl) oxazole compound and preparation method and application thereof 中国医科大学 2021-06-08 CN disclosed