SCHEMBL9498749

SCHEMBL9498749

O=S(=O)(c1[c]cccc1)c1ccc(Cl)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.42
KIF18A Q8NI77 1/20 0.40
HSD11B1 P28845 2/20 0.40
TRPV4 Q9HBA0 1/20 0.40
ITGA1 P56199 4/20 0.39
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
ALOX12 P18054 1/20 0.37
KMT2A Q03164 1/20 0.37
NLRP1 Q9C000 1/20 0.37
FLT1 P17948 1/20 0.35
FLT4 P35916 1/20 0.35
KDR P35968 1/20 0.35
KDM4E B2RXH2 1/20 0.35
SLC40A1 Q9NP59 2/20 0.35
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
MCL1 Q07820 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
SCHEMBL10438584 0.84 AKR1B1 (0.45) AKR1B1MEN1KMT2ATSHR
SCHEMBL5146128 0.83 HSD11B1 (0.45) AKR1B1HSD11B1ALDH1A1TSHR
SCHEMBL9482319 0.81 MCL1 (0.42) HSD11B1ALDH1A1MEN1LMNAMAPT
SCHEMBL11490322 0.78 KIF18A (0.36) KIF18A
SCHEMBL6335085 0.76 AKR1B1 (0.56) AKR1B1HSD11B1TRPV4ITGA1ALDH1A1
SCHEMBL29001803 0.76 ALDH1A1 (0.54) KIF18AHSD11B1ALDH1A1MEN1LMNA
Hydrochloric Acid SCHEMBL11256201 0.74 AKR1B1 (0.54) AKR1B1HSD11B1TRPV4ITGA1ALDH1A1
SCHEMBL150811 0.74 HTR6 (0.38) MEN1KMT2A
SCHEMBL2462163 0.74 KIF18A (0.61) AKR1B1KIF18AHSD11B1TRPV4ITGA1
SCHEMBL28243733 0.72 MAPT (0.43) HSD11B1ALDH1A1LMNAMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0351332-B1 HERBICIDAL COMPOUNDS AND COMPOSITIONS CONTAINING THEM RHONE-POULENC AGROCHIMIE (FR) 1993-03-24 EP disclosed
EP-0351332-A1 Herbicidal compounds and compositions containing them RHONE-POULENC AGROCHIMIE (FR) 1990-01-17 EP disclosed