SCHEMBL13677142

SCHEMBL13677142

CC(=O)c1ccc(C(=O)Nc2ccc(N)c(S(=O)(=O)O)c2)c(S(=O)(=O)O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTDSP1 Q9GZU7 2/20 0.43
HPGD P15428 1/20 0.42
ENPP2 Q13822 2/20 0.42
MAPT P10636 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PTGER4 P35408 1/20 0.40
KMT2A Q03164 4/20 0.39
FADS1 O60427 1/20 0.39
POLB P06746 1/20 0.39
CDC25B P30305 1/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
CASP6 P55212 1/20 0.39
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL17491043 0.88 KMT2A (0.51) CTDSP1HPGDENPP2MAPTNPC1
SCHEMBL2622523 0.84 RAB9A (0.46) HPGDMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL2622513 0.84 PRKCI (0.43) HPGDENPP2MAPTNPC1RAB9A
SCHEMBL16488366 0.81 F2 (0.42) HPGDMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL2622518 0.80 KMT2A (0.42) HPGDENPP2MAPTNPC1RAB9A
SCHEMBL394298 0.80 MEN1 (0.60) CTDSP1ENPP2MAPTNPC1RAB9A
SCHEMBL11588532 0.80 ENPP2 (0.44) CTDSP1HPGDENPP2KMT2APOLB
SCHEMBL66550 0.79 ENPP2 (0.60) CTDSP1ENPP2MAPTNPC1RAB9A
SCHEMBL28468127 0.79 HPGD (0.41) HPGDMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL9810108 0.79 FADS1 (0.56) CTDSP1NPC1RAB9ASMN1; SMN2KMT2A

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
WO-2009130675-A1 ORGANIC COMPOUND, OPTICAL FILM AND METHOD OF PRODUCTION THEREOF CRYSOPTIX KK (JP) 2009-10-29 WO disclosed