SCHEMBL806369

SCHEMBL806369

Cc1ccc(Oc2ccc(N(c3ccc(C)cc3)c3ccc(C=O)cc3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 3/20 0.57
KDM4E B2RXH2 3/20 0.53
ALDH1A1 P00352 5/20 0.48
ALDH1A3 P47895 2/20 0.48
ALDH3A1 P30838 1/20 0.48
CYP2A13 Q16696 1/20 0.47
PARP10 Q53GL7 1/20 0.46
PARP3 Q9Y6F1 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.43
LMNA P02545 2/20 0.43
TEAD4 Q15561 1/20 0.42
MAPT P10636 2/20 0.41
POLB P06746 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
RELA Q04206 1/20 0.40
HPGD P15428 1/20 0.40
MMP13 P45452 1/20 0.39
HTT P42858 1/20 0.39
MMP2 P08253 2/20 0.38
MMP9 P14780 2/20 0.38

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
SCHEMBL10062321 0.91 PARP10 (0.53) CYP2A6KDM4EALDH1A1ALDH1A3ALDH3A1
SCHEMBL339173 0.89 CYP2A6 (0.73) CYP2A6KDM4EALDH1A1ALDH1A3ALDH3A1
SCHEMBL13158692 0.89 CYP2A6 (0.73) CYP2A6KDM4EALDH1A1ALDH1A3ALDH3A1
SCHEMBL260405 0.89 CYP2A6 (0.73) CYP2A6KDM4EALDH1A1ALDH1A3PARP10
SCHEMBL13158697 0.89 CYP2A6 (0.73) CYP2A6KDM4EALDH1A1ALDH1A3ALDH3A1
SCHEMBL23975504 0.89 CYP2A6 (0.73) CYP2A6KDM4EALDH1A1ALDH1A3PARP10
SCHEMBL3340810 0.89 CYP2A6 (0.73) CYP2A6KDM4EALDH1A1ALDH1A3ALDH3A1
SCHEMBL7864818 0.88 ALDH1A1 (0.66) CYP2A6KDM4EALDH1A1ALDH1A3ALDH3A1
SCHEMBL10028278 0.86 ALDH1A1 (0.68) CYP2A6KDM4EALDH1A1ALDH1A3ALDH3A1
SCHEMBL16922613 0.85 RELA (0.57) KDM4EALDH1A1TEAD4MAPTPOLB

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-2012036295-A1 ELECTROPHOTOGRAPHIC PHOTOCONDUCTOR, IMAGE FORMING METHOD, IMAGE FORMING APPARATUS, AND PROCESS CARTRIDGE RICOH COMPANY, LTD. (JP) 2012-03-22 WO disclosed