SCHEMBL7487017

SCHEMBL7487017

CCN(CC)c1[c]cccc1-c1ccc(N(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.39
ALDH1A1 P00352 6/20 0.34
HSD17B10 Q99714 3/20 0.34
TSHR P16473 2/20 0.34
ALOX15 P16050 1/20 0.34
MAPT P10636 6/20 0.34
CYP3A4 P08684 3/20 0.34
KDM4E B2RXH2 3/20 0.34
HPGD P15428 3/20 0.34
MAPK1 P28482 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
CYP1A2 P05177 2/20 0.34
CYP2C19 P33261 2/20 0.34
ACHE P22303 2/20 0.34
CYP2D6 P10635 1/20 0.34
HIF1A Q16665 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
RAB9A P51151 4/20 0.33
NPC1 O15118 3/20 0.33
RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL7702911 0.75 ALDH1A1 (0.41) ALDH1A1HSD17B10TSHRALOX15MAPT
SCHEMBL14871679 0.74 ACHE (0.42) ALDH1A1HSD17B10TSHRMAPTCYP3A4
SCHEMBL5133030 0.72 CYP1A2 (0.37) ALDH1A1HSD17B10TSHRALOX15MAPT
SCHEMBL5358732 0.71 ALDH1A1 (0.43) ALDH1A1HSD17B10TSHRALOX15MAPT
SCHEMBL3149293 0.71 MEN1 (0.39) ALDH1A1HSD17B10MAPTKDM4EHPGD
SCHEMBL9297636 0.70 DDB1 (0.32) ALDH1A1MAPTMAPK1TDP1RAB9A
SCHEMBL19698857 0.69 ALDH1A1 (0.58) ALDH1A1HSD17B10TSHRALOX15MAPT
SCHEMBL6455528 0.69 AR (0.33) ALDH1A1TSHRMAPTCYP3A4MAPK1
SCHEMBL11129070 0.69 S100B (0.33) ALDH1A1TSHRCYP3A4KDM4EMAPK1
SCHEMBL2964345 0.67 MAPT (0.34) ALDH1A1TSHRMAPTCYP3A4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1025107-B1 PHOTOCHROMIC COMPOUNDS JAMES ROBINSON LTD (GB) 2002-08-07 EP claimed