SCHEMBL11333313

SCHEMBL11333313

CCCCCCCCOc1ccc2c(c1)C(=O)NC2=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 7/20 0.61
MAOB P27338 7/20 0.61
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
NPC1 O15118 1/20 0.52
ALDH1A1 P00352 1/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
RAB9A P51151 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
PTPN11 Q06124 2/20 0.50
PTPN1 P18031 1/20 0.50
THRA P10827 1/20 0.48
THRB P10828 1/20 0.48
MMP2 P08253 1/20 0.48
MMP3 P08254 1/20 0.48
MMP9 P14780 1/20 0.48
NR5A1 Q13285 1/20 0.47
PDK2 Q15119 1/20 0.47
LMNA P02545 1/20 0.47

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
SCHEMBL11518444 0.95 MAOA (0.66) MAOAMAOBMEN1KMT2ANPC1
SCHEMBL7284252 0.89 MAOA (0.63) MAOAMAOBMEN1KMT2ANPC1
SCHEMBL28037754 0.82 MAPT (0.69) MEN1KMT2ANPC1ALDH1A1GAA
SCHEMBL7619627 0.82 MAPT (0.69) MEN1KMT2ANPC1ALDH1A1GAA
SCHEMBL918880 0.82 MAPT (0.69) MEN1KMT2ANPC1ALDH1A1GAA
SCHEMBL31003494 0.82 MAPT (0.74) MEN1KMT2ANPC1ALDH1A1GAA
SCHEMBL538924 0.82 MAPT (0.74) MEN1KMT2ANPC1ALDH1A1GAA
SCHEMBL11411139 0.82 MAOA (0.61) MAOAMAOBMEN1KMT2AALDH1A1
SCHEMBL11834242 0.81 PTPN11 (0.53) MEN1KMT2ANPC1ALDH1A1GAA
SCHEMBL7271528 0.81 PTPN11 (0.53) MEN1KMT2ANPC1ALDH1A1GAA

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
US-4308341-A PROVIDING ISOINDOZE DYES BY REACTION OF COBALT AMINE LIGANDS AND AROMATIC DIALDEHYDES EASTMAN KODAK COMPANY (US) 1981-12-29 US disclosed