SCHEMBL6565230

SCHEMBL6565230

CCOc1ccc2nc(C3(c4nc5ccc(OCC)cc5c(=O)o4)CCCCC3)oc(=O)c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.44
TP53 P04637 6/20 0.44
ALDH1A1 P00352 5/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
MAPT P10636 3/20 0.44
CYP1A2 P05177 4/20 0.43
KDM4E B2RXH2 4/20 0.43
HPGD P15428 4/20 0.43
HSD17B10 Q99714 4/20 0.43
TSHR P16473 3/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA4 P22748 1/20 0.42
CA6 P23280 1/20 0.42
CA5A P35218 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
CA5B Q9Y2D0 1/20 0.42

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
SCHEMBL6564012 0.86 C1R (0.49) SMN1; SMN2ALDH1A1NPC1RAB9AMAPT
SCHEMBL6564183 0.82 KMT2A (0.54) SMN1; SMN2ALDH1A1NPC1RAB9AMAPT
SCHEMBL6563999 0.81 ELANE (0.43) SMN1; SMN2ALDH1A1MAPTCYP1A2KDM4E
SCHEMBL6566035 0.80 ELANE (0.57) SMN1; SMN2ALDH1A1NPC1RAB9AMAPT
SCHEMBL6566028 0.78 SIGMAR1 (0.36) SMN1; SMN2TP53ALDH1A1MAPTCYP1A2
SCHEMBL6567168 0.77 ELANE (0.37) ELANETYMS
SCHEMBL6565063 0.77 C1R (0.46) SMN1; SMN2ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL6564170 0.76 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1NPC1RAB9AMAPT
SCHEMBL6565228 0.75 SMN1; SMN2 (0.45) SMN1; SMN2TP53ALDH1A1NPC1RAB9A
SCHEMBL6563940 0.75 SMN1; SMN2 (0.74) SMN1; SMN2TP53ALDH1A1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0993965-B1 Thermally sensitive recording medium JUJO PAPER CO LTD (JP) 2004-03-31 EP disclosed
US-6440897-B1 BIS-BENZOXAZINONE COMPOUND AS AN ULTRAVIOLET RAY ABSORBING AGENT NIPPON PAPER INDUSTRIES CO LTD (JP) 2002-08-27 US disclosed
EP-0993965-A2 Thermally sensitive recording medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2000-04-19 EP disclosed