SCHEMBL6566025

SCHEMBL6566025

CCC(=O)c1ccc2nc(C3CCCCC3c3nc4ccc(C(=O)CC)cc4c(=O)o3)oc(=O)c2c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.37
POLB P06746 1/20 0.37
NPC1 O15118 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ELANE P08246 4/20 0.36
SIGMAR1 Q99720 1/20 0.35
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HPGD P15428 1/20 0.34
USP2 O75604 1/20 0.34
TP53 P04637 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
MAPT P10636 1/20 0.34
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL6564167 0.86 ALDH1A1 (0.40) POLBNPC1MEN1KMT2AELANE
SCHEMBL6564024 0.86 IP6K1 (0.41) POLBMEN1KMT2AELANEKDM4E
SCHEMBL6563997 0.80 ELANE (0.44) POLBMEN1KMT2AELANEALDH1A1
SCHEMBL6566030 0.78 ELANE (0.59) POLBNPC1MEN1KMT2AELANE
SCHEMBL6566008 0.77 ELANE (0.50) ATMMEN1KMT2AELANEKDM4E
SCHEMBL6565228 0.77 SMN1; SMN2 (0.45) ATMPOLBNPC1MEN1KMT2A
SCHEMBL6564175 0.76 KMT2A (0.55) POLBNPC1MEN1KMT2AKDM4E
SCHEMBL6564016 0.76 ALDH1A1 (0.56) POLBNPC1MEN1KMT2AELANE
SCHEMBL6565060 0.76 C1R (0.47) POLBELANEKDM4EALDH1A1L3MBTL1
SCHEMBL6567166 0.76 ELANE (0.38) ELANE

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