SCHEMBL6092618

SCHEMBL6092618

Cn1nc(C(F)(F)F)nc1S(C)(=O)=O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MITF O75030 1/20 0.49
ALPL P05186 1/20 0.49
POLB P06746 1/20 0.49
MAPT P10636 1/20 0.49
APEX1 P27695 1/20 0.49
APOBEC3A P31941 1/20 0.49
HTT P42858 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
APOBEC3G Q9HC16 1/20 0.49
PTGS1 P23219 5/20 0.34
PTGS2 P35354 5/20 0.34
CA12 O43570 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SDHB P21912 1/20 0.30
GLP1R P43220 1/20 0.30
CYP2C9 P11712 1/20 0.30

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
SCHEMBL6089921 0.78 MITF (0.36) MITFALPLPOLBMAPTAPEX1
SCHEMBL6091209 0.77 PTGS1 (0.32) MITFALPLPOLBMAPTAPEX1
SCHEMBL6090782 0.77 PTGS2 (0.36) MITFALPLPOLBMAPTAPEX1
SCHEMBL4781697 0.69 HTT (0.35) POLBHTT
SCHEMBL9972335 0.69 HTT (0.32) HTT
SCHEMBL6092950 0.68 ALOX15 (0.31) HTT
SCHEMBL10748672 0.67 POLB (0.33) POLBHTT
SCHEMBL10573778 0.67 HTT (0.31) HTT
SCHEMBL18865739 0.67 HTT (0.38) HTT
SCHEMBL2889631 0.67 HTT (0.31) HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015117912-A1 PESTICIDALLY ACTIVE AMIDE DERIVATIVES WITH SULPHUR CONTAINING SUBSTITUENTS SYNGENTA PARTICIPATIONS AG (CH) 2015-08-13 WO disclosed
WO-2006099957-A1 INSECTICIDAL AND ACARICIDAL ANILINOTRIAZOLES BAYER CROPSCIENCE AG (DE) 2006-09-28 WO disclosed
EP-0192180-B1 5-(AZOLYLOXYPHENYLCARBAMOYL)-BARBITURIC ACID DERIVATIVES AS ACTIVE AGENTS IN ANTHELMICS CIBA-GEIGY AG (CH) 1989-08-09 EP disclosed
US-4762830-A 5-(azolyloxyphenylcarbamoyl)barbituric acid derivatives as anthelmintics CIBA-GEIGY CORPORATION (US) 1988-08-09 US disclosed
EP-0192180-A1 5-(Azolyloxyphenylcarbamoyl)-barbituric acid derivatives as active agents in anthelmics CIBA-GEIGY AG (CH) 1986-08-27 EP disclosed