SCHEMBL9566079

SCHEMBL9566079

CON(C)C(C)=NN=C(c1ccc(Cl)cc1)c1ccc(OS(C)(=O)=O)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.38
ALDH1A1 P00352 2/20 0.37
CYP11B1 P15538 3/20 0.36
CYP11B2 P19099 3/20 0.36
HPGD P15428 1/20 0.35
RAB9A P51151 3/20 0.35
PKM P14618 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
PTPN1 P18031 1/20 0.34
PPARG P37231 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
ENPP3 O14638 1/20 0.33
ENPP1 P22413 1/20 0.33
ENPP2 Q13822 1/20 0.33
MAOB P27338 2/20 0.33
MAOA P21397 1/20 0.33
NPC1 O15118 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
SCHEMBL9566100 0.87 ALDH1A1 (0.35) NFE2L2ALDH1A1CYP11B1CYP11B2HPGD
SCHEMBL10969828 0.83 CA1 (0.41) NFE2L2ALDH1A1CYP11B1CYP11B2HPGD
SCHEMBL9566069 0.79 RAB9A (0.45) NFE2L2ALDH1A1CYP11B1CYP11B2HPGD
SCHEMBL29386050 0.79 STS (0.38) NFE2L2ALDH1A1CYP11B1CYP11B2HPGD
SCHEMBL15138714 0.79 STS (0.38) NFE2L2ALDH1A1CYP11B1CYP11B2HPGD
SCHEMBL15129863 0.79 STS (0.38) NFE2L2ALDH1A1CYP11B1CYP11B2HPGD
SCHEMBL9566152 0.76 PAX8 (0.36) ALDH1A1RAB9AMEN1KMT2AMAOB
SCHEMBL9565958 0.76 DRD2 (0.35) ALDH1A1CYP11B1CYP11B2CA1CA2
SCHEMBL9565985 0.75 CYP11B1 (0.34) NFE2L2ALDH1A1CYP11B1CYP11B2HPGD
SCHEMBL9566056 0.74 CYP11B1 (0.34) NFE2L2ALDH1A1CYP11B1CYP11B2HPGD

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-0566534-A1 Derivatives of benzophenone CIBA-GEIGY AG (CH) 1993-10-20 EP claimed
EP-0566534-A1 Derivatives of benzophenone CIBA-GEIGY AG (CH) 1993-10-20 EP disclosed