SCHEMBL17346271

SCHEMBL17346271

O=C(O)c1ccc(OF)c(F)c1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.70
HTT P42858 2/20 0.70
LMNA P02545 2/20 0.70
MAPK1 P28482 1/20 0.70
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA4 P22748 2/20 0.50
CA6 P23280 2/20 0.50
CA7 P43166 2/20 0.50
CA9 Q16790 2/20 0.50
CA14 Q9ULX7 2/20 0.50
TPMT P51580 1/20 0.50
TSHR P16473 4/20 0.47
KDM4E B2RXH2 3/20 0.47
GAA P10253 2/20 0.47
ALDH1A1 P00352 1/20 0.47
MRGPRX4 Q96LA9 3/20 0.44
TTR P02766 2/20 0.43
TP53 P04637 1/20 0.42

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
SCHEMBL16358344 0.84 HTT (0.55) RAB9AHTTLMNAMAPK1CA12
SCHEMBL31493230 0.82 HTT (1.00) RAB9AHTTLMNAMAPK1CA12
SCHEMBL503994 0.82 HTT (1.00) RAB9AHTTLMNAMAPK1CA12
SCHEMBL9623610 0.81 LMNA (0.66) RAB9AHTTLMNAMAPK1CA12
SCHEMBL229063 0.79 TSHR (0.71) RAB9AHTTLMNAMAPK1CA12
SCHEMBL20042919 0.79 HTT (0.64) RAB9AHTTLMNAMAPK1CA12
SCHEMBL30147631 0.79 HTT (0.64) RAB9AHTTLMNAMAPK1CA12
SCHEMBL30929945 0.79 RAB9A (0.64) RAB9AHTTLMNAMAPK1CA12
SCHEMBL30147507 0.79 RAB9A (0.64) RAB9AHTTLMNAMAPK1CA12
SCHEMBL12490198 0.79 RAB9A (0.64) RAB9AHTTLMNAMAPK1CA12

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
WO-2023009785-A1 TEAD INHIBITORS AND USES THEREOF CEDILLA THERAPEUTICS, INC. (US) 2023-02-02 WO disclosed
WO-2015189901-A1 HYDANTOIN DERIVATIVE-CONTAINING PHARMACEUTICAL COMPOSITION 中外製薬株式会社 2015-12-17 WO disclosed
WO-2015190451-A1 HYDANTOIN DERIVATIVE-CONTAINING PHARMACEUTICAL COMPOSITION 中外製薬株式会社 2015-12-17 WO disclosed