SCHEMBL7933949

SCHEMBL7933949

[O]c1nccc(Cl)c1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 16/20 0.41
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CHRNB2 P17787 1/20 0.38
CYP2B6 P20813 1/20 0.38
MAOA P21397 1/20 0.38
CYP2C19 P33261 1/20 0.38
CHRNA4 P43681 1/20 0.38
HTR3A P46098 1/20 0.38
NOS3 P29474 1/20 0.36
NOS2 P35228 1/20 0.36
DAO P14920 1/20 0.33
KMO O15229 1/20 0.33
SMARCA2 P51531 1/20 0.33
SMARCA4 P51532 1/20 0.33

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
SCHEMBL739829 0.80 NOTUM (0.42) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL29427142 0.80 NOTUM (0.42) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL20836150 0.78 NOTUM (0.42) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL31194141 0.78 NOTUM (0.42) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL6971788 0.77 NOTUM (0.39) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL17506246 0.77 NOTUM (0.39) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL30901272 0.77 NOTUM (0.39) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL3945531 0.77 NOTUM (0.39) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL17537336 0.77 NOTUM (0.39) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6
SCHEMBL3080097 0.76 NOTUM (0.40) NOTUMCYP1A2CYP2C9CHRNB2CYP2B6

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
EP-0810823-B1 COMPOSITION FOR CONTROLLING PARASITES NOVARTIS AG (CH) 2001-03-14 EP disclosed
US-5994395-A MIXTURE CONTAINING AN ACYLUREA AROMATIC COMPOUND AND ANTIBIOTIC NOVARTIS ANIMAL HEALTH US, INC. (US) 1999-11-30 US disclosed
EP-0810823-A1 COMPOSITION FOR CONTROLLING PARASITES Novartis AG (CH) 1997-12-10 EP disclosed
WO-1996025852-A1 COMPOSITION FOR CONTROLLING PARASITES NOVARTIS AG (CH) 1996-08-29 WO disclosed