SCHEMBL8903209

SCHEMBL8903209

C=CC1Cc2c(OC)ccc(OC)c2C(=O)O1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLL Q9UGP5 1/20 0.52
ACHE P22303 2/20 0.49
KDM4E B2RXH2 8/20 0.41
ALDH1A1 P00352 4/20 0.41
HPGD P15428 4/20 0.41
GAA P10253 2/20 0.41
GLA P06280 1/20 0.41
PTPRF P10586 1/20 0.40
HSD17B10 Q99714 2/20 0.39
ADRA1A P35348 1/20 0.38
MAPT P10636 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
USP2 O75604 1/20 0.37
DUSP3 P51452 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
POLB P06746 1/20 0.34
PABPC1 P11940 1/20 0.34
APEX1 P27695 1/20 0.34
RECQL P46063 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
SCHEMBL30487601 0.69 POLL (1.00) POLL
SCHEMBL8901958 0.68 ADRA1A (0.41) ACHEADRA1A
SCHEMBL13925647 0.68 POLL (0.72) POLLACHEKDM4EMAPTPOLB
SCHEMBL6204130 0.67 KDM4E (0.57) POLLACHEKDM4EALDH1A1HPGD
SCHEMBL28370465 0.67 POLL (0.70) POLLACHEKDM4EALDH1A1HPGD
SCHEMBL11869676 0.66 ACHE (1.00) POLLACHEKDM4EALDH1A1HPGD
SCHEMBL10982867 0.65 ACHE (0.62) POLLACHEKDM4EALDH1A1HPGD
SCHEMBL8903286 0.63 ADRA1A (0.46) POLLACHEKDM4EALDH1A1HPGD
SCHEMBL13925630 0.63 MAOA (0.64) POLLACHEKDM4EALDH1A1HPGD
SCHEMBL13925633 0.63 MAOA (0.64) POLLACHEKDM4EALDH1A1HPGD

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
US-5593970-A ANTITUMOR AND ANTCARCINOGENIC AGENTS; TRETMENT OF CANCEROUS BONE MARROW BEFORE REGRAFTING BIOCHEM PHARMA INC. (CA) 1997-01-14 US disclosed
EP-0533744-A1 HETEROCYCLIC ANTHRACYCLIONE AND ANTHRACYCLINE ANALOGS BIOCHEM PHARMA INC. (CA) 1993-03-31 EP disclosed
WO-1991019725-A2 HETEROCYCLIC ANTHRACYCLIONE AND ANTHRACYCLINE ANALOGS BIOCHEM PHARMA INC. (CA) 1991-12-26 WO disclosed