SCHEMBL7948228

SCHEMBL7948228

CCn1ncc(C(=O)c2ccc(S(C)(=O)=O)c(-c3ccc(OC)cc3F)c2C)c1O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP7 Q93009 1/20 0.36
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
CPS1 P31327 2/20 0.34
PRKCZ Q05513 1/20 0.34
POLQ O75417 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
GLA P06280 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
CTSA P10619 1/20 0.32
KAT6A Q92794 1/20 0.32
METAP2 P50579 1/20 0.32
PRKAB2 O43741 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
SCHEMBL7947377 0.89 RAB9A (0.35) NPC1RAB9A
SCHEMBL7949472 0.86 LMNA (0.35) KDM4EALDH1A1HPGDNPC1RAB9A
SCHEMBL7939695 0.85 MAPK1 (0.37) PTGS1PTGS2KDM4EALDH1A1HPGD
SCHEMBL7946251 0.85 RAB9A (0.36) PTGS2KDM4EALDH1A1NPC1RAB9A
SCHEMBL7946284 0.83 LMNA (0.34) KDM4EALDH1A1HPGDNPSR1NPC1
SCHEMBL7939787 0.80 PTGS2 (0.38) PTGS1PTGS2KDM4EALDH1A1CYP1A2
SCHEMBL7946322 0.80 LMNA (0.41) PTGS2ALDH1A1HPGDNPC1RAB9A
SCHEMBL7946282 0.80 MAPT (0.36) KDM4EALDH1A1GLANPSR1NPC1
SCHEMBL8183276 0.80 LMNA (0.36) ALDH1A1CYP1A2CYP2C19RAB9A
SCHEMBL7939860 0.79 SMN1; SMN2 (0.35) ALDH1A1CYP1A2CYP2C19NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6265606-B1 TO CONTROL A BROAD SPECTRUM OF UNDESIRABLE VEGETATION, ARE SELECTIVE TO MAJOR CROPS, HAVE DESIRABLE ENVIRONMENTAL PROFILES, DOW AGROSCIENCES LLC 2001-07-24 US disclosed
US-6010981-A 1-alkyl-4-benzoyl-5-hydroxypyrazole compounds and their use as herbicides DOW AGROSCIENCES LLC (US) 2000-01-04 US disclosed
EP-0914317-A2 1-ALKYL-4-BENZOYL-5-HYDROXYPYRAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES Dow AgroSciences LLC (US) 1999-05-12 EP disclosed
WO-1998052926-A2 1-ALKYL-4-BENZOYL-5-HYDROXYPYRAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 1998-11-26 WO disclosed