SCHEMBL9803597

SCHEMBL9803597

O=C1OC(C=C(c2ccc(N3CCCCC3)cc2)c2ccc(N3CCCCC3)cc2)(C=C(c2ccc(N3CCCCC3)cc2)c2ccc(N3CCCCC3)cc2)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.46
RAB9A P51151 4/20 0.46
MAPT P10636 4/20 0.46
TP53 P04637 3/20 0.46
ALDH1A1 P00352 3/20 0.46
HPGD P15428 3/20 0.46
TSHR P16473 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ALOX15 P16050 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
LMNA P02545 1/20 0.46
STAT1 P42224 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ERBB2 P04626 1/20 0.41
PDK2 Q15119 2/20 0.41
CHRM5 P08912 1/20 0.40
KDM4E B2RXH2 1/20 0.39
MAPK1 P28482 1/20 0.39
CASP1 P29466 1/20 0.39
CASP7 P55210 1/20 0.39

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
SCHEMBL1617467 0.99 NPC1 (0.47) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL9558112 0.90 ALDH1A1 (0.45) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL9558103 0.90 ALDH1A1 (0.45) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL1618209 0.89 ALDH1A1 (0.43) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL1617727 0.88 ALDH1A1 (0.43) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL1617907 0.85 MAPT (0.40) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL1617957 0.84 MAPT (0.39) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL9557823 0.83 RAB9A (0.37) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL1618378 0.82 ALDH1A1 (0.42) NPC1RAB9AMAPTTP53ALDH1A1
SCHEMBL1618083 0.82 RAB9A (0.40) NPC1RAB9AMAPTTP53ALDH1A1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0232907-B1 HEAT-SENSITIVE RECORDING MATERIAL KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1991-03-27 EP disclosed
EP-0196484-B1 PRESSURE SENSITIVE MANIFOLD SHEET KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1990-05-09 EP disclosed
US-4761396-A BASIC PHTHALIDE DYE REACTS WITH FLUORENE DERIVATIVE AND P-PHENYLENEDIAMINE DERIVATIVE KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1988-08-02 US disclosed
US-4704379-A Pressure sensitive manifold sheet KANZAKI PAPER MANUFACTURING CO. LTD. (JP) 1987-11-03 US disclosed
EP-0196484-A1 Pressure sensitive manifold sheet KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1986-10-08 EP disclosed
US-4580153-A COLOR FORMING BETWEEN COLORLESS CHROMOGENIC VINYL PHTHALIDE COMPOUND AND ELECTRON ACCEPTOR KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1986-04-01 US disclosed