SCHEMBL9750124

SCHEMBL9750124

CCN(CC)c1ccc(C(=CC(C=C(c2ccc(Cl)cc2)c2ccc(N(CC)CC)cc2)c2cc(C)ccc2C(N)=O)c2ccc(Cl)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.40
CNR1 P21554 5/20 0.40
MAPT P10636 7/20 0.38
ALDH1A1 P00352 5/20 0.38
GAA P10253 3/20 0.38
HTT P42858 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CYP3A4 P08684 2/20 0.36
KDM4E B2RXH2 3/20 0.35
HPGD P15428 3/20 0.35
POLB P06746 1/20 0.35
RAB9A P51151 1/20 0.35
GLA P06280 1/20 0.35
GFER P55789 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
ATM Q13315 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ESRRG P62508 2/20 0.34
TP53 P04637 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
SCHEMBL9749549 0.95 MAPT (0.38) MAPTALDH1A1GAAHTTNPSR1
SCHEMBL9749956 0.91 MAPT (0.40) CNR2CNR1MAPTALDH1A1GAA
SCHEMBL9750137 0.88 ALDH1A1 (0.44) MAPTALDH1A1GAAKDM4EHPGD
SCHEMBL9750392 0.87 MAPT (0.39) CNR2CNR1MAPTALDH1A1GAA
SCHEMBL9750417 0.82 MAPT (0.42) MAPTALDH1A1GAAHTTCYP3A4
SCHEMBL9838423 0.81 MAPT (0.41) MAPTALDH1A1GAAHTTCYP3A4
SCHEMBL9749697 0.81 MAPT (0.41) CNR2MAPTALDH1A1GAAHTT
SCHEMBL9750055 0.80 MAPT (0.38) MAPTALDH1A1GAAHTTCYP3A4
SCHEMBL9840314 0.79 ALDH1A1 (0.47) MAPTALDH1A1HTTNPSR1CYP3A4
SCHEMBL9749572 0.79 ALDH1A1 (0.45) MAPTALDH1A1GAAKDM4EHPGD

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