SCHEMBL9614432

SCHEMBL9614432

CCOc1cc(S(=O)(=O)Cl)c2ccc3c(S(=O)(=O)Cl)cc(S(=O)(=O)Cl)c4ccc1c2c43

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV4 Q9HBA0 2/20 0.49
▸ TSHR P16473 5/20 0.37
▸ MAPT P10636 2/20 0.36
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ CA14 Q9ULX7 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.35
▸ ALPL P05186 3/20 0.35
▸ ALDH1A1 P00352 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ POLB P06746 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ SLC2A1 P11166 1/20 0.35

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
SCHEMBL9614320 0.97 TRPV4 (0.49) TRPV4TSHRMAPTCA12CA1
SCHEMBL10076070 0.84 HSD17B10 (0.42) TRPV4TSHRMAPTCA12CA1
SCHEMBL590866 0.81 MAPT (0.50) TRPV4TSHRMAPTCA12CA1
SCHEMBL11038732 0.78 TRPV4 (0.36) TRPV4TDP1ALDH1A1HSD17B10
SCHEMBL9614394 0.78 CA12 (0.43) TSHRMAPTCA12CA1CA2
SCHEMBL19274350 0.77 HSD17B10 (0.40) TRPV4TSHRMAPTCA12CA1
SCHEMBL4925230 0.74 TRPV4 (0.33) TRPV4
SCHEMBL9614315 0.73 HTT (0.39) TRPV4TSHRMAPTTDP1ALDH1A1
SCHEMBL17695444 0.73 HSD17B10 (0.39) TSHRMAPTTDP1ALDH1A1MEN1
SCHEMBL19939980 0.72 HTT (0.35) TRPV4TSHRMAPTTDP1ALDH1A1

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
EP-0396732-A4 FLUORESCENT IMMUNOASSAYS AND FLUORESCENT COMPOUNDS AND TRACERS THEREFORE — 1992-10-07 — — EP disclosed
EP-0396732-A1 FLUORESCENT IMMUNOASSAYS AND FLUORESCENT COMPOUNDS AND TRACERS THEREFORE DOWBEN, Robert M. (US) 1990-11-14 — — EP disclosed
WO-1990005916-A1 FLUORESCENT IMMUNOASSAYS AND FLUORESCENT COMPOUNDS AND TRACERS THEREFORE DOWBEN ROBERT M (US) 1990-05-31 — — WO disclosed
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