SCHEMBL22503246

SCHEMBL22503246

O=C(NS(=O)(=O)C(F)(F)F)C12CC3CC(CC(O)(C3)C1)C2

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.42
PREP P48147 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 3/20 0.39
CNR2 P34972 3/20 0.38
CNR1 P21554 2/20 0.38
THRB P10828 1/20 0.38
P2RX7 Q99572 1/20 0.37
PKM P14618 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ABL1 P00519 1/20 0.36
TSHR P16473 1/20 0.36
RIN1 Q13671 1/20 0.36
GAA P10253 1/20 0.34

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
SCHEMBL22503106 0.87 HSD11B1 (0.31) HSD11B1
SCHEMBL2742128 0.84 ALDH1A1 (0.43) SMN1; SMN2KDM4EALDH1A1P2RX7
SCHEMBL22503142 0.79 THRB (0.39) ALDH1A1THRBPKMGAA
SCHEMBL21599233 0.79 PKM (0.35) ALDH1A1THRBPKMGAA
SCHEMBL22317700 0.77 THRB (0.40) ALDH1A1THRBPKM
SCHEMBL22503138 0.76 THRB (0.32) THRB
SCHEMBL22166143 0.75 THRB (0.33) ALDH1A1THRBPKM
SCHEMBL22166148 0.75 THRB (0.33) ALDH1A1THRBPKM
SCHEMBL20364781 0.75 THRB (0.33) ALDH1A1THRBPKM
SCHEMBL15116366 0.74 DPP4 (0.38) ALDH1A1PKM

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
US-20230161252-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-25 US disclosed
US-20230161252-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-25 US disclosed
US-10792489-B2 Bio-electrode composition, bio-electrode, and method for manufacturing the bio-electrode SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-10-06 US disclosed