SCHEMBL6566028

SCHEMBL6566028

CCC(=O)c1ccc2nc(C3(c4nc5ccc(C(=O)CC)cc5c(=O)o4)CCCCC3)oc(=O)c2c1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.36
ATM Q13315 1/20 0.36
ELANE P08246 4/20 0.35
MAPT P10636 3/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
TSHR P16473 1/20 0.35
MEN1 O00255 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
KMT2A Q03164 1/20 0.34
KDM4E B2RXH2 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ADORA3 P0DMS8 1/20 0.32

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
SCHEMBL6564170 0.87 ALDH1A1 (0.42) ELANEMAPTALDH1A1MEN1CYP1A2
SCHEMBL6564027 0.87 IP6K1 (0.40) ELANEMAPTALDH1A1MEN1TP53
SCHEMBL6563999 0.81 ELANE (0.43) ELANEMAPTALDH1A1HPGDTSHR
SCHEMBL6566035 0.79 ELANE (0.57) ELANEMAPTALDH1A1MEN1KMT2A
SCHEMBL6565230 0.78 SMN1; SMN2 (0.44) ATMELANEMAPTALDH1A1HPGD
SCHEMBL6567168 0.76 ELANE (0.37) ELANE
SCHEMBL6565947 0.76 MEN1 (0.46) ATMELANEMAPTALDH1A1HPGD
SCHEMBL6566008 0.76 ELANE (0.50) ATMELANEMAPTMEN1TP53
SCHEMBL6565063 0.76 C1R (0.46) ELANEALDH1A1HPGDCYP2D6KDM4E
SCHEMBL6564012 0.76 C1R (0.49) MAPTALDH1A1HPGDTSHRCYP1A2

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