SCHEMBL9750108

SCHEMBL9750108

CCOC(=O)C(C(=O)OCC)C(C=C(c1ccc(OC)cc1)c1ccc(N(C)C)cc1)C=C(c1ccc(OC)cc1)c1ccc(N(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.47
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44
ATM Q13315 1/20 0.43
MAPT P10636 7/20 0.43
NPC1 O15118 4/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
RAB9A P51151 3/20 0.43
TP53 P04637 1/20 0.43
ESR2 Q92731 1/20 0.43
NOX1 Q9Y5S8 1/20 0.43
CYP1A2 P05177 2/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
GPR183 P32249 1/20 0.42
TSHR P16473 2/20 0.41
LMNA P02545 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
SLC2A1 P11166 1/20 0.41

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
SCHEMBL9749954 0.90 MAPT (0.45) MAOBATMMAPTNPC1SMN1; SMN2
SCHEMBL9750389 0.89 MAOB (0.50) MAOBATMMAPTNPC1SMN1; SMN2
SCHEMBL9750046 0.80 ALDH1A1 (0.44) MAPTNPC1SMN1; SMN2RAB9AMEN1
SCHEMBL9749589 0.77 RAB9A (0.50) MAPTNPC1SMN1; SMN2RAB9ATP53
SCHEMBL9839717 0.77 HDAC3 (0.43) KMT2ALMNAALDH1A1KDM4EHDAC3
SCHEMBL9839736 0.77 ALDH1A1 (0.42) MAOBFNTAFNTBMAPTNPC1
SCHEMBL9750115 0.76 ALDH1A1 (0.55) MAPTNPC1SMN1; SMN2RAB9AKMT2A
SCHEMBL9838206 0.74 ALDH1A1 (0.48) MAPTNPC1SMN1; SMN2RAB9ATP53
SCHEMBL17432769 0.72 HDAC3 (0.53) CYP1A2ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL9750072 0.72 MAPT (0.47) MAOBATMMAPTNPC1SMN1; SMN2

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
US-5084593-A Cyanine, aniline dyes for heat sensitive recording elements RICOH COMPANY, LTD. (JP) 1992-01-28 US disclosed
US-5008238-A Thermosensitive material with phenolic developer RICOH COMPANY, LTD. (JP) 1991-04-16 US disclosed