SCHEMBL9750072

SCHEMBL9750072

COc1ccc(/C(=C/C(/C=C(/c2ccc(OC)cc2)c2ccc(N(C)C)cc2)CC(=O)CC(C)=O)c2ccc(N(C)C)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.47
CYP1A2 P05177 3/20 0.47
MAOB P27338 1/20 0.46
RAB9A P51151 4/20 0.45
NPC1 O15118 4/20 0.45
SMN1; SMN2 Q16637 4/20 0.45
TP53 P04637 1/20 0.45
ESR2 Q92731 1/20 0.45
NOX1 Q9Y5S8 1/20 0.45
ATM Q13315 1/20 0.43
GAA P10253 3/20 0.42
LMNA P02545 4/20 0.42
ALDH1A1 P00352 4/20 0.41
HPGD P15428 2/20 0.41
HTT P42858 1/20 0.41
TSHR P16473 2/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CYP3A4 P08684 2/20 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
SCHEMBL9750086 0.91 ALDH1A1 (0.42) MAPTRAB9ANPC1SMN1; SMN2GAA
SCHEMBL9749957 0.85 HDAC3 (0.40) MAPTLMNAALDH1A1HPGDHTT
SCHEMBL9750171 0.83 MAPT (0.41) MAPTCYP1A2RAB9ANPC1SMN1; SMN2
SCHEMBL9750077 0.80 MAPT (0.53) MAPTCYP1A2MAOBRAB9ANPC1
SCHEMBL9750389 0.75 MAOB (0.50) MAPTCYP1A2MAOBRAB9ANPC1
SCHEMBL9750108 0.72 MAOB (0.47) MAPTCYP1A2MAOBRAB9ANPC1
SCHEMBL9839720 0.71 EGFR (0.39) MAPTTP53NOX1GAALMNA
SCHEMBL10473228 0.71 MAOB (0.56) MAPTCYP1A2MAOBRAB9ANPC1
SCHEMBL10473229 0.71 MAOB (0.56) MAPTCYP1A2MAOBRAB9ANPC1
SCHEMBL9749600 0.70 RAB9A (0.53) MAPTRAB9ANPC1SMN1; SMN2TP53

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