Anthracene

Anthracene

SCHEMBL5604192

CC(=O)OOC(C)=O.c1ccc2cc3ccccc3cc2c1

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.44
ALDH1A1 P00352 6/20 0.44
HPGD P15428 4/20 0.44
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
LMNA P02545 2/20 0.42
ELANE P08246 1/20 0.42
CYP3A4 P08684 1/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C19 P33261 2/20 0.41
GLA P06280 2/20 0.41
HSD17B10 Q99714 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
BACE1 P56817 1/20 0.41
GAA P10253 2/20 0.41
HIF1A Q16665 1/20 0.40
PDGFRB P09619 1/20 0.40
FGFR1 P11362 1/20 0.40

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
Naphthalene SCHEMBL27879233 0.90 CYP2A6 (0.44) KDM4EALDH1A1HPGDCES2CES1
Anthracene SCHEMBL11730397 0.85 ALDH1A1 (0.50) KDM4EALDH1A1HPGDCES2CES1
Anthracene SCHEMBL28851488 0.84 CES2 (0.50) KDM4EALDH1A1HPGDCES2CES1
Anthracene SCHEMBL27577677 0.81 CES2 (0.48) KDM4EALDH1A1HPGDCES2CES1
Anthracene SCHEMBL8740461 0.81 KDM4E (0.52) KDM4EALDH1A1HPGDCES2CES1
Anthracene SCHEMBL28769838 0.81 KDM4E (0.52) KDM4EALDH1A1HPGDCES2CES1
Benz(B)Anthracene SCHEMBL31229359 0.79 ALDH1A1 (0.50) KDM4EALDH1A1HPGDCES2CES1
SCHEMBL4783814 0.79 CYP1A2 (0.50) KDM4EALDH1A1HPGDCES2CES1
Acetamide SCHEMBL28304289 0.77 ALDH1A1 (0.52) KDM4EALDH1A1HPGDCES2CES1
Acetamide SCHEMBL28326863 0.77 ALDH1A1 (0.52) KDM4EALDH1A1HPGDCES2CES1

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-0997482-B1 MODIFIED CYCLOOLEFIN ADDITION POLYMER AND CURABLE RESIN COMPOSITION CONTAINING THE SAME NIPPON ZEON CO (JP) 2007-01-17 EP disclosed
US-6346581-B1 CURABLE COMPOSITION COMPRISING POLYMER OBTAINED BY INTRODUCING FUNCTIONAL GROUP INTO CYCLOOLEFIN ADDITION POLYMER CONSISTING OF UNITS DERIVED FROM CYCLOOLEFIN MONOMERS WITH AND WITHOUT SIDE CHAIN HAVING 4 OR MORE CARBONS, HARDENING AGENT NIPPON ZEON CO., LTD (JP) 2002-02-12 US disclosed
EP-0997482-A1 MODIFIED CYCLOOLEFIN ADDITION POLYMER AND CURABLE RESIN COMPOSITION CONTAINING THE SAME NIPPON ZEON CO., LTD. (JP) 2000-05-03 EP disclosed