SCHEMBL30410880

SCHEMBL30410880

N#Cc1cc(I)ccc1Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 2/20 0.45
▸ TEAD1 P28347 1/20 0.43
▸ TEAD4 Q15561 1/20 0.43
▸ TEAD2 Q15562 1/20 0.43
▸ DHODH Q02127 3/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ GAA P10253 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ TRPV1 Q8NER1 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ GFER P55789 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ AKR1C3 P42330 1/20 0.39
▸ AKR1C2 P52895 1/20 0.39
▸ TAS2R14 Q9NYV8 2/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ LRRK2 Q5S007 1/20 0.36
▸ PTPN1 P18031 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
SCHEMBL20767101 1.00 KIF11 (0.45) KIF11TEAD1TEAD4TEAD2DHODH
SCHEMBL20552318 0.84 LRRK2 (0.50) KIF11TEAD1TEAD4TEAD2DHODH
SCHEMBL20552520 0.82 KIF11 (0.45) KIF11TEAD1TEAD4TEAD2DHODH
SCHEMBL20553084 0.82 SLC22A12 (0.47) KIF11TEAD1TEAD4TEAD2DHODH
SCHEMBL20552788 0.82 LRRK2 (0.49) KIF11TEAD1TEAD4TEAD2DHODH
SCHEMBL20552334 0.79 TRPV1 (0.44) KIF11TEAD1TEAD4TEAD2DHODH
SCHEMBL20553063 0.79 LRRK2 (0.52) KIF11TEAD1TEAD4TEAD2DHODH
SCHEMBL20553187 0.78 TEAD1 (0.53) KIF11TEAD1TEAD4TEAD2DHODH
SCHEMBL26665296 0.77 MAPT (0.43) KIF11TEAD1DHODHKDM4EMEN1
SCHEMBL20552937 0.77 MEN1 (0.43) KIF11TEAD1TEAD4TEAD2DHODH

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-111542315-B Benzosulfonyl compounds 维瓦斯治疗公司 2023-05-12 — — CN disclosed
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