SCHEMBL9749697

SCHEMBL9749697

CCN(CC)c1ccc(C(=CC(C=C(c2ccc(N(CC)CC)cc2)c2ccc(N(CC)CC)cc2)c2ccccc2C(N)=O)c2ccc(N(CC)CC)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.41
ALDH1A1 P00352 8/20 0.41
KDM4E B2RXH2 5/20 0.41
HPGD P15428 4/20 0.41
GAA P10253 4/20 0.41
GLA P06280 2/20 0.41
GFER P55789 1/20 0.41
ESRRG P62508 3/20 0.41
NPC1 O15118 5/20 0.40
RAB9A P51151 5/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
TP53 P04637 2/20 0.40
LMNA P02545 2/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
CNR2 P34972 1/20 0.40
HSD11B1 P28845 1/20 0.40
MEN1 O00255 6/20 0.40
KMT2A Q03164 6/20 0.40

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
SCHEMBL9750392 0.94 MAPT (0.39) MAPTALDH1A1KDM4EHPGDGAA
SCHEMBL9749968 0.87 MAPT (0.47) MAPTALDH1A1KDM4EHPGDNPC1
SCHEMBL9749549 0.85 MAPT (0.38) MAPTALDH1A1KDM4EHPGDGAA
SCHEMBL9749956 0.84 MAPT (0.40) MAPTALDH1A1KDM4EHPGDGAA
SCHEMBL9750055 0.82 MAPT (0.38) MAPTALDH1A1KDM4EHPGDGAA
SCHEMBL9749975 0.81 ALDH1A1 (0.47) MAPTALDH1A1KDM4EHPGDGAA
SCHEMBL9750124 0.81 CNR2 (0.40) MAPTALDH1A1KDM4EHPGDGAA
SCHEMBL9840314 0.81 ALDH1A1 (0.47) MAPTALDH1A1KDM4ERAB9ASMN1; SMN2
SCHEMBL9749664 0.80 KMT2A (0.41) MAPTALDH1A1KDM4EHPGDGAA
SCHEMBL9750036 0.76 MAPT (0.44) MAPTALDH1A1KDM4EHPGDGAA

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