SCHEMBL9720382

SCHEMBL9720382

COc1ccc(Oc2ccc(NC(=S)NC(=O)c3c(F)cccc3F)cc2Cl)c2ccccc12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.53
MAPT P10636 5/20 0.53
NPC1 O15118 5/20 0.53
RAB9A P51151 5/20 0.53
HPGD P15428 1/20 0.53
ALDH1A1 P00352 4/20 0.53
ALOX12 P18054 2/20 0.53
ESRRA P11474 4/20 0.52
STK39 Q9UEW8 1/20 0.52
LMNA P02545 2/20 0.50
POLB P06746 1/20 0.49
NPSR1 Q6W5P4 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
GLA P06280 1/20 0.48
MET P08581 1/20 0.47
KDR P35968 1/20 0.47
KIT P10721 1/20 0.47
PDGFRA P16234 1/20 0.47
S1PR1 P21453 1/20 0.46

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
SCHEMBL8657630 0.90 POLB (0.47) SMN1; SMN2MAPTNPC1RAB9AHPGD
SCHEMBL8674230 0.88 KIT (0.47) SMN1; SMN2MAPTNPC1RAB9AHPGD
SCHEMBL5824966 0.88 KDR (0.62) METKDRKITPDGFRA
SCHEMBL8656131 0.85 ESRRA (0.51) SMN1; SMN2MAPTNPC1RAB9AHPGD
SCHEMBL9134978 0.82 POLB (0.47) SMN1; SMN2MAPTNPC1RAB9AHPGD
SCHEMBL8660852 0.82 ESRRA (0.48) MAPTALDH1A1ESRRALMNAPOLB
SCHEMBL8659697 0.82 ESRRA (0.61) SMN1; SMN2MAPTNPC1RAB9AHPGD
SCHEMBL10961870 0.80 RAB9A (0.49) SMN1; SMN2MAPTNPC1RAB9AHPGD
SCHEMBL8658892 0.80 ESRRA (0.46) SMN1; SMN2MAPTHPGDALDH1A1ALOX12
SCHEMBL5825282 0.80 PDGFRA (0.71) SMN1; SMN2MAPTNPC1RAB9AHPGD

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
US-5135953-A Oral or injections; cattle, swine, poultry CIBA-GEIGY (US) 1992-08-04 US disclosed
EP-0211004-A1 USE OF ACYL UREA COMPOUNDS FOR CONTROLLING ENDOPARASITES AND ECTOPARASITES OF WARM-BLOODED ANIMALS RHONE-POULENC NEDERLAND B.V. (NL) 1987-02-25 EP disclosed
WO-1986003941-A1 USE OF ACYL UREA COMPOUNDS FOR CONTROLLING ENDOPARASITES AND ECTOPARASITES OF WARM-BLOODED ANIMALS UNION CARBIDE CORPORATION (US) 1986-07-17 WO disclosed