SCHEMBL9803569

SCHEMBL9803569

CCN(CC)c1ccc2c(c1)-c1cc(N(CC)CC)ccc1C2c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.43
CYP3A4 P08684 3/20 0.43
S100B P04271 1/20 0.42
MEN1 O00255 7/20 0.41
KMT2A Q03164 7/20 0.41
L3MBTL1 Q9Y468 5/20 0.41
MAPT P10636 5/20 0.41
MAPK1 P28482 3/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 1/20 0.41
CNR2 P34972 2/20 0.41
TSHR P16473 3/20 0.40
PSMD14 O00487 1/20 0.40
RECQL P46063 1/20 0.40
GFER P55789 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
TERT O14746 1/20 0.40
GAA P10253 5/20 0.39
NPC1 O15118 4/20 0.39
RAB9A P51151 4/20 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
Bromide SCHEMBL8982805 0.98 ALDH1A1 (0.42) ALDH1A1CYP3A4S100BMEN1KMT2A
SCHEMBL9803843 0.90 ALDH1A1 (0.47) ALDH1A1CYP3A4S100BMEN1KMT2A
SCHEMBL10771511 0.87 MEN1 (0.42) ALDH1A1CYP3A4S100BMEN1KMT2A
SCHEMBL9803564 0.85 S100B (0.41) ALDH1A1CYP3A4S100BMEN1KMT2A
SCHEMBL80719 0.83 ALDH1A1 (0.42) ALDH1A1CYP3A4S100BMEN1KMT2A
SCHEMBL82135 0.83 MEN1 (0.52) ALDH1A1CYP3A4S100BMEN1KMT2A
SCHEMBL9803217 0.82 ALDH1A1 (0.43) ALDH1A1CYP3A4S100BMEN1KMT2A
SCHEMBL4859207 0.81 ALDH1A1 (0.38) ALDH1A1CYP3A4MEN1KMT2AMAPT
SCHEMBL13050776 0.77 ALDH1A1 (0.45) ALDH1A1CYP3A4MEN1KMT2AL3MBTL1
SCHEMBL11084097 0.76 ALDH1A1 (0.54) ALDH1A1CYP3A4MEN1KMT2AL3MBTL1

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
EP-0232907-B1 HEAT-SENSITIVE RECORDING MATERIAL KANZAKI PAPER MANUFACTURING COMPANY LIMITED (JP) 1991-03-27 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