SCHEMBL23635115

SCHEMBL23635115

Cc1cc(Cl)cc(S(=O)(=O)C2CC2)c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.36
RAPGEF4 Q8WZA2 1/20 0.35
SPR P35270 1/20 0.35
FFAR4 Q5NUL3 1/20 0.34
ACLY P53396 1/20 0.34
EDNRB P24530 2/20 0.33
EDNRA P25101 2/20 0.33
PGR P06401 2/20 0.33
NR3C1 P04150 1/20 0.33
NR3C2 P08235 1/20 0.33
S100A9 P06702 1/20 0.33
FEN1 P39748 1/20 0.33
STS P08842 1/20 0.32
HTR2A P28223 2/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
DRD2 P14416 1/20 0.32
HTR2C P28335 1/20 0.32
KCNH2 Q12809 1/20 0.32

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
SCHEMBL17027799 0.88 CNR1 (0.41) CNR1SPRACLYS100A9STS
SCHEMBL26069625 0.78 ALDH1A1 (0.44) CNR1
SCHEMBL16771112 0.76 GABRA1 (0.42) CNR1SPRS100A9
Hydrochloric Acid SCHEMBL17061868 0.74 GABRA1 (0.41) CNR1SPRHTR2C
SCHEMBL24757946 0.74 PTGS2 (0.40) RAPGEF4FFAR4ACLYPGRFEN1
SCHEMBL2055455 0.74 FFAR4 (0.39) RAPGEF4FFAR4ACLYEDNRBEDNRA
SCHEMBL23375706 0.74 TPMT (0.57) CNR1SPRACLY
SCHEMBL17027820 0.73 TMEM97 (0.52) HTR2AHTR2C
SCHEMBL788179 0.73 TSHR (0.44) CNR1RAPGEF4FFAR4ACLYEDNRB
SCHEMBL21462481 0.72 CNR1 (0.33) CNR1SPRS100A9STSHTR2A

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
EP-3107909-B1 ANTIMITOTIC AMIDES FOR THE TREATMENT OF CANCER AND PROLIFERATIVE DISORDERS FROST BIOLOGIC INC (US) 2021-07-14 EP disclosed