SCHEMBL9566039

SCHEMBL9566039

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

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 5/20 0.35
ENPP3 O14638 4/20 0.35
ENPP2 Q13822 3/20 0.35
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
CYP11B1 P15538 4/20 0.33
CYP11B2 P19099 4/20 0.33
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CXCR2 P25025 1/20 0.32
NFE2L2 Q16236 1/20 0.32
HPGD P15428 1/20 0.32
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31
ALDH1A1 P00352 1/20 0.31
AKR1C3 P42330 1/20 0.31

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
SCHEMBL9565985 0.86 CYP11B1 (0.34) ENPP1ENPP3ENPP2PKMRAB9A
SCHEMBL9566100 0.86 ALDH1A1 (0.35) ENPP1ENPP3ENPP2PKMRAB9A
SCHEMBL9566056 0.85 CYP11B1 (0.34) ENPP1ENPP3ENPP2PKMRAB9A
SCHEMBL8540709 0.78 ENPP1 (0.38) ENPP1ENPP3ENPP2CXCR2HPGD
SCHEMBL9416661 0.77 RAB9A (0.42) ENPP1ENPP3ENPP2PKMRAB9A
SCHEMBL9565958 0.77 DRD2 (0.35) ENPP1ENPP3ENPP2CYP11B1CYP11B2
SCHEMBL9566161 0.77 PSEN1 (0.35) ENPP1ENPP3ENPP2CXCR2HPGD
SCHEMBL9566010 0.77 ALDH1A1 (0.35) ENPP1ENPP3ENPP2PKMRAB9A
SCHEMBL8535326 0.76 ENPP1 (0.36) ENPP1ENPP3ENPP2CYP11B1CYP11B2
SCHEMBL10969416 0.76 GAA (0.38) ENPP1ENPP3ENPP2CXCR2PSEN1

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

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