SCHEMBL31543771

SCHEMBL31543771

Cc1c(F)c(C#N)nc(Nc2ccc(I)cc2F)c1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAP2K1 Q02750 17/20 0.49
▸ MAP2K2 P36507 5/20 0.45
▸ IDO1 P14902 1/20 0.40
▸ PTGFR P43088 1/20 0.39
▸ FLT1 P17948 1/20 0.36

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
SCHEMBL31376766 0.81 MAP2K1 (0.56) MAP2K1MAP2K2IDO1
SCHEMBL31135614 0.80 MAP2K1 (0.59) MAP2K1MAP2K2IDO1
SCHEMBL23851383 0.80 MAP2K1 (0.59) MAP2K1MAP2K2IDO1
SCHEMBL31135631 0.75 MAP2K1 (0.50) MAP2K1MAP2K2IDO1FLT1
SCHEMBL23850846 0.75 MAP2K1 (0.50) MAP2K1MAP2K2IDO1FLT1
SCHEMBL24196106 0.73 MAP2K1 (0.48) MAP2K1MAP2K2IDO1
SCHEMBL24558816 0.73 MAP2K1 (0.51) MAP2K1MAP2K2IDO1
SCHEMBL23852559 0.73 MAP2K1 (0.52) MAP2K1MAP2K2IDO1
SCHEMBL31403386 0.73 MAP2K1 (0.52) MAP2K1MAP2K2IDO1
SCHEMBL23851097 0.73 MAP2K1 (0.62) MAP2K1MAP2K2IDO1

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
CN-113473978-B Cyanoarene-aniline compounds for the treatment of skin disorders 恩福莱克逊治疗有限公司 2025-03-28 — — CN disclosed
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