SCHEMBL6571163

SCHEMBL6571163

Cc1cccc(-c2[c]c3c(cc2)-c2ccccc2C3)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
GAA P10253 2/20 0.38
CASP6 P55212 1/20 0.38
ALDH1A1 P00352 5/20 0.36
SMN1; SMN2 Q16637 5/20 0.36
MAPT P10636 4/20 0.36
RAB9A P51151 4/20 0.36
NPC1 O15118 3/20 0.36
NFKB1 P19838 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
PARP10 Q53GL7 1/20 0.35
PARP11 Q9NR21 1/20 0.35
HPGD P15428 4/20 0.35
KDM4E B2RXH2 3/20 0.35
LMNA P02545 3/20 0.35
PDK2 Q15119 1/20 0.35
HTT P42858 3/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL2047309 0.89 PARP10 (0.44) GAAALDH1A1SMN1; SMN2MAPTRAB9A
SCHEMBL216860 0.83 ALDH1A1 (0.38) GAAALDH1A1SMN1; SMN2MAPTRAB9A
SCHEMBL217877 0.77 ALDH1A1 (0.36) MEN1KMT2ACASP6ALDH1A1SMN1; SMN2
SCHEMBL313500 0.74 PNMT (0.44) MEN1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL216980 0.73 ALDH1A1 (0.40) MEN1KMT2AGAAALDH1A1SMN1; SMN2
SCHEMBL717055 0.73 TDP2 (0.46) MEN1KMT2ASMN1; SMN2MAPTRAB9A
SCHEMBL2968041 0.72 KDM4E (0.33) MEN1KMT2AALDH1A1SMN1; SMN2MAPT
SCHEMBL28946045 0.72 PNMT (0.45) MEN1KMT2AGAACASP6ALDH1A1
SCHEMBL1029595 0.72 KDM4E (0.34) MEN1KMT2AGAAALDH1A1SMN1; SMN2
SCHEMBL2051092 0.72 ESR1 (0.36) PDK2PGR

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-0970964-B1 Method for producing a titanium complex SUMITOMO CHEMICAL CO (JP) 2004-04-21 EP disclosed
EP-0970964-A2 Method for producing titanium complex SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-01-12 EP disclosed