SCHEMBL6566012

SCHEMBL6566012

CCOc1ccc2nc(CC(C)c3nc4ccc(OCC)cc4c(=O)o3)oc(=O)c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.48
TP53 P04637 5/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
ALDH1A1 P00352 6/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KDM4E B2RXH2 5/20 0.42
HPGD P15428 4/20 0.42
HSD17B10 Q99714 4/20 0.42
CYP1A2 P05177 3/20 0.42
TSHR P16473 2/20 0.42
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
CASP1 P29466 3/20 0.40
CASP7 P55210 3/20 0.40
MAPK1 P28482 1/20 0.40
APP P05067 1/20 0.40
HTT P42858 1/20 0.39
TERT O14746 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
SCHEMBL6567412 0.88 ELANE (0.50) ELANESMN1; SMN2ALDH1A1MAPTNPC1
SCHEMBL6567154 0.84 KMT2A (0.52) ELANESMN1; SMN2ALDH1A1MAPTNPC1
SCHEMBL6566018 0.83 SMN1; SMN2 (0.48) ELANETP53SMN1; SMN2ALDH1A1MAPT
SCHEMBL6565646 0.82 ELANE (0.48) ELANEALDH1A1MAPTKDM4EMEN1
SCHEMBL6565609 0.82 ELANE (0.55) ELANESMN1; SMN2ALDH1A1MAPTNPC1
SCHEMBL6567158 0.81 ELANE (0.49) ELANETP53ALDH1A1MAPTNPC1
SCHEMBL6565331 0.81 ELANE (0.49) ELANEALDH1A1KDM4EHSD17B10MEN1
SCHEMBL6565211 0.81 ELANE (0.49) ELANEALDH1A1MAPTRAB9AKDM4E
SCHEMBL6567394 0.81 ELANE (0.49) ELANEALDH1A1KDM4EMEN1KMT2A
SCHEMBL6565061 0.80 ELANE (0.47) ELANETP53ALDH1A1KDM4EMEN1

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