SCHEMBL9566010

SCHEMBL9566010

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

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.35
ENPP3 O14638 3/20 0.35
ENPP1 P22413 3/20 0.35
ENPP2 Q13822 1/20 0.35
CTSL P07711 4/20 0.34
CTSK P43235 1/20 0.34
RAB9A P51151 3/20 0.34
PKM P14618 1/20 0.34
CXCR2 P25025 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
NPC1 O15118 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
CTSB P07858 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
SCHEMBL9416661 0.88 RAB9A (0.42) ALDH1A1ENPP3ENPP1ENPP2RAB9A
SCHEMBL10973313 0.81 MEN1 (0.42) ALDH1A1ENPP3ENPP1ENPP2CXCR2
SCHEMBL9079609 0.81 MEN1 (0.42) ALDH1A1ENPP3ENPP1ENPP2CXCR2
SCHEMBL9565985 0.79 CYP11B1 (0.34) ALDH1A1ENPP3ENPP1ENPP2RAB9A
SCHEMBL9566100 0.79 ALDH1A1 (0.35) ALDH1A1ENPP3ENPP1ENPP2RAB9A
SCHEMBL8539695 0.79 ENPP1 (0.41) ALDH1A1ENPP3ENPP1ENPP2CXCR2
SCHEMBL7104412 0.78 ENPP1 (0.41) ALDH1A1ENPP3ENPP1ENPP2CXCR2
SCHEMBL7104414 0.78 ENPP1 (0.41) ALDH1A1ENPP3ENPP1ENPP2CXCR2
SCHEMBL9566058 0.78 CXCR2 (0.37) ALDH1A1ENPP1ENPP2CTSLCTSK
SCHEMBL9566056 0.78 CYP11B1 (0.34) ALDH1A1ENPP3ENPP1ENPP2RAB9A

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