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Sugi Predict / Compounds / SCHEMBL24254766

SCHEMBL24254766

SCHEMBL24254766

Fc1c(F)c(N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)c(F)c(F)c1-c1c(F)c(F)c(N(c2ccc(C(F)(F)F)cc2)c2ccc(C(F)(F)F)cc2)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 1/20 0.38
▸ KIF11 P52732 7/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ CES2 O00748 1/20 0.33
▸ CES1 P23141 1/20 0.33
▸ ORAI1 Q96D31 1/20 0.33
▸ ORAI2 Q96SN7 1/20 0.33
▸ ORAI3 Q9BRQ5 1/20 0.33
▸ TRPV6 Q9H1D0 1/20 0.33
▸ CYP3A4 P08684 1/20 0.32
▸ PDE2A O00408 1/20 0.32
▸ AHR P35869 1/20 0.32
▸ TAAR1 Q96RJ0 1/20 0.31
▸ EPHX2 P34913 1/20 0.31

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
SCHEMBL25639243 0.82 GRIN2B (0.32) —
SCHEMBL25639264 0.81 — —
SCHEMBL24254860 0.78 GLA (0.37) MGLLTSHRCES2
SCHEMBL4298574 0.78 MGLL (0.50) MGLLKIF11ALDH1A1TSHRCES2
SCHEMBL20100709 0.74 ALDH1A1 (0.39) MGLLALDH1A1TSHRCYP3A4
SCHEMBL24254641 0.73 ALDH1A1 (0.38) MGLLKIF11ALDH1A1TSHRTRPV6
SCHEMBL24254815 0.73 — —
SCHEMBL25639155 0.72 GRIN2B (0.32) —
SCHEMBL12937145 0.72 ESR1 (0.43) —
SCHEMBL27256051 0.72 KIF11 (0.53) KIF11ALDH1A1TSHRTRPV6CYP3A4

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
WO-2022034907-A1 METAL PATTERNING MATERIAL, AMINE COMPOUND, ELECTRONIC DEVICE, AND METHOD FOR FORMING METAL PATTERN 東ソー株式会社 2022-02-17 — — WO disclosed