SCHEMBL6565631

SCHEMBL6565631

CCC(=O)c1ccc2nc(C(CC)c3nc4ccc(C(=O)CC)cc4c(=O)o3)oc(=O)c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HTT P42858 1/20 0.43
ELANE P08246 7/20 0.39
ATM Q13315 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
USP2 O75604 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
MAPT P10636 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
LMNA P02545 1/20 0.34
POLB P06746 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
SCHEMBL6567556 0.88 ELANE (0.44) KDM4EALDH1A1HTTELANEMEN1
SCHEMBL6565623 0.83 ELANE (0.44) KDM4EALDH1A1HTTELANEATM
SCHEMBL6566008 0.81 ELANE (0.50) KDM4EELANEATMMEN1KMT2A
SCHEMBL6565217 0.81 MAPT (0.47) KDM4EALDH1A1HTTELANEMEN1
SCHEMBL6564016 0.80 ALDH1A1 (0.56) KDM4EALDH1A1ELANEMEN1KMT2A
SCHEMBL6565611 0.79 ELANE (0.62) KDM4EALDH1A1HTTELANEMEN1
SCHEMBL6565648 0.78 ELANE (0.48) KDM4EALDH1A1HTTELANEMEN1
SCHEMBL6567161 0.78 TP53 (0.51) KDM4EALDH1A1HTTELANEMEN1
SCHEMBL6567397 0.78 ALDH1A1 (0.48) KDM4EALDH1A1HTTELANEMEN1
SCHEMBL6565334 0.78 KDM4E (0.47) KDM4EALDH1A1HTTELANE

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