SCHEMBL23601099

SCHEMBL23601099

Cc1c(F)c(F)c(F)c(C(=O)O)c1S

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
TAS1R3 Q7RTX0 12/20 0.36
TAS1R1 Q7RTX1 11/20 0.36
TAS1R2 Q8TE23 11/20 0.36
MAPK1 P28482 1/20 0.36
PKM P14618 1/20 0.33
HCAR2 Q8TDS4 1/20 0.31
CES2 O00748 1/20 0.31
CES1 P23141 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
SCHEMBL2011531 0.84 MEN1 (0.46) MEN1KMT2ASMN1; SMN2CRHBPCRHR2
SCHEMBL23601121 0.81 MEN1 (0.36) MEN1KMT2ASMN1; SMN2CRHBPCRHR2
SCHEMBL28126998 0.81 MEN1 (0.47) MEN1KMT2ASMN1; SMN2CRHBPCRHR2
SCHEMBL2860749 0.79 TAS1R3 (0.44) MEN1KMT2ASMN1; SMN2CRHBPCRHR2
SCHEMBL23601101 0.79 TAS1R3 (0.34) MEN1KMT2ASMN1; SMN2CRHBPCRHR2
SCHEMBL503607 0.79 TAS1R3 (0.47) MEN1KMT2ASMN1; SMN2CRHBPCRHR2
SCHEMBL2470702 0.77 TAS1R3 (0.45) MEN1KMT2ASMN1; SMN2CRHBPCRHR2
Hydrochloric Acid SCHEMBL6740806 0.77 TAS1R3 (0.45) MEN1KMT2ASMN1; SMN2CRHBPCRHR2
SCHEMBL13447235 0.77 TAS1R3 (0.41) MEN1KMT2ASMN1; SMN2CRHBPCRHR2
SCHEMBL7074989 0.77 TAS1R3 (0.41) MEN1KMT2ASMN1; SMN2CRHBPCRHR2

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-2021131845-A1 RADIATION-SENSITIVE RESIN COMPOSITION AND METHOD FOR FORMING PATTERN JSR株式会社 2021-07-01 WO disclosed