SCHEMBL5406327

SCHEMBL5406327

CCOc1cc(F)ccc1S(=O)(=O)Cl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 2/20 0.61
MAPT P10636 3/20 0.46
ALDH1A1 P00352 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
LMNA P02545 3/20 0.45
HTT P42858 2/20 0.45
POLB P06746 1/20 0.42
KDM4E B2RXH2 2/20 0.41
MRGPRX1 Q96LB2 4/20 0.40
TSHR P16473 1/20 0.40
CYP2D6 P10635 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP1A2 P05177 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HRH4 Q9H3N8 1/20 0.39
ADRA1D P25100 2/20 0.38
ADRA1A P35348 2/20 0.38
ADRA1B P35368 2/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL24314192 0.87 TRPV4 (0.50) TRPV4MAPTALDH1A1NPSR1LMNA
SCHEMBL29588407 0.83 CA12 (0.50) TRPV4MAPTALDH1A1NPSR1LMNA
SCHEMBL22587747 0.83 CA12 (0.50) TRPV4MAPTALDH1A1NPSR1LMNA
SCHEMBL25045969 0.81 TRPV4 (0.63) TRPV4MAPTALDH1A1NPSR1LMNA
SCHEMBL30002818 0.81 TRPV4 (0.66) TRPV4ALDH1A1LMNAHTTPOLB
SCHEMBL1817556 0.81 TRPV4 (0.66) TRPV4ALDH1A1LMNAHTTPOLB
SCHEMBL16469895 0.80 TRPV4 (0.61) TRPV4MAPTALDH1A1LMNAHTT
SCHEMBL8764653 0.80 TRPV4 (0.57) TRPV4MAPTALDH1A1NPSR1LMNA
SCHEMBL31511099 0.79 TRPV4 (0.55) TRPV4MAPTALDH1A1NPSR1HTT
SCHEMBL8726763 0.79 TRPV4 (0.55) TRPV4MAPTALDH1A1NPSR1HTT

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022081842-A1 SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER THE BROAD INSTITUTE, INC. (US) 2022-04-21 WO disclosed
WO-2022081807-A1 SUBSTITUTED ACYL SULFONAMIDES FOR TREATING CANCER THE BROAD INSTITUTE, INC. (US) 2022-04-21 WO disclosed
US-RE39607-E1 Herbicidal sulphonylamino(thio) carbonyl compounds BAYER AKTIENGESELLSCHAFT (DE) 2007-05-01 US disclosed
US-RE39607-E1 Herbicidal sulphonylamino(thio) carbonyl compounds BAYER AKTIENGESELLSCHAFT (DE) 2007-05-01 US disclosed
US-RE39607-E1 Herbicidal sulphonylamino(thio) carbonyl compounds BAYER AKTIENGESELLSCHAFT (DE) 2007-05-01 US disclosed
US-6525211-B1 Chemical intermediates BAYER AKTIENGESELLSCHAFT (DE) 2003-02-25 US disclosed
US-6251831-B1 WITH SUBSTITUTED PHENYL AND SUBSTITUTED 1,2,4-TRIAZOLE MOIETIES; PRE- AND POST-EMERGENCE HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 2001-06-26 US disclosed