SCHEMBL9749549

SCHEMBL9749549

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 13/20 0.38
ALDH1A1 P00352 10/20 0.38
HPGD P15428 5/20 0.38
GAA P10253 5/20 0.38
KDM4E B2RXH2 4/20 0.38
GLA P06280 1/20 0.38
GFER P55789 1/20 0.38
MEN1 O00255 8/20 0.38
KMT2A Q03164 8/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ATM Q13315 1/20 0.38
ESRRG P62508 4/20 0.37
TSHR P16473 3/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX15 P16050 1/20 0.37
CASP1 P29466 1/20 0.37
HSD17B10 Q99714 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
POLB P06746 6/20 0.36

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
SCHEMBL9750124 0.95 CNR2 (0.40) MAPTALDH1A1HPGDGAAKDM4E
SCHEMBL9749956 0.87 MAPT (0.40) MAPTALDH1A1HPGDGAAKDM4E
SCHEMBL9750417 0.87 MAPT (0.42) MAPTALDH1A1HPGDGAAKDM4E
SCHEMBL9838423 0.86 MAPT (0.41) MAPTALDH1A1HPGDGAAKDM4E
SCHEMBL9749697 0.85 MAPT (0.41) MAPTALDH1A1HPGDGAAKDM4E
SCHEMBL9750055 0.84 MAPT (0.38) MAPTALDH1A1HPGDGAAKDM4E
SCHEMBL9840314 0.84 ALDH1A1 (0.47) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL9750060 0.83 RAB9A (0.43) MAPTALDH1A1HPGDGAAKDM4E
SCHEMBL9750137 0.82 ALDH1A1 (0.44) MAPTALDH1A1HPGDGAAKDM4E
SCHEMBL9750392 0.81 MAPT (0.39) MAPTALDH1A1HPGDGAAKDM4E

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 4 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-5057154-A Colorfastness, stability RICOH COMPANY, LTD. (JP) 1991-10-15 US disclosed
US-5008238-A Thermosensitive material with phenolic developer RICOH COMPANY, LTD. (JP) 1991-04-16 US disclosed
US-4939117-A Leuco dyes and recording material employing the same RICOH COMPANY, LTD. (JP) 1990-07-03 US disclosed