SCHEMBL6239976

SCHEMBL6239976

COC1(O)C(=O)c2ccccc2OC1(OC)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.39
ALOX15 P16050 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 4/20 0.36
ALDH1A1 P00352 3/20 0.36
HPGD P15428 2/20 0.36
GLA P06280 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
RAB9A P51151 2/20 0.34
GAA P10253 2/20 0.34
CFTR P13569 1/20 0.34
GOPC Q9HD26 1/20 0.34
ATM Q13315 1/20 0.34
KMT2A Q03164 3/20 0.34
CYP2C19 P33261 2/20 0.34
MEN1 O00255 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPK1 P28482 3/20 0.33
CYP2C9 P11712 3/20 0.33
CA1 P00915 1/20 0.33

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
SCHEMBL726440 0.71 CA1 (0.35) CYP3A4ALOX15MAPTALDH1A1HPGD
SCHEMBL4226505 0.71 ALDH1A1 (0.43) CYP3A4ALOX15SMN1; SMN2MAPTALDH1A1
SCHEMBL727643 0.69 MAPT (0.40) CYP3A4ALOX15SMN1; SMN2MAPTALDH1A1
SCHEMBL28970951 0.68 TXNRD1 (0.36) GAAKMT2AMEN1CA1CA2
SCHEMBL3222985 0.67 ALDH1A1 (0.48) ALOX15SMN1; SMN2MAPTALDH1A1HPGD
SCHEMBL31517193 0.67 CYP2C19 (0.33) CYP3A4ALOX15SMN1; SMN2MAPTKMT2A
SCHEMBL1165001 0.67 CYP2C19 (0.38) CYP3A4ALOX15KMT2ACYP2C19MEN1
SCHEMBL27660494 0.66 KDM4E (0.40) CYP3A4MAPTALDH1A1HPGDKMT2A
SCHEMBL28140395 0.66 CYP3A4 (0.47) CYP3A4ALOX15SMN1; SMN2MAPTGLA
SCHEMBL28524099 0.65 STK17B (0.36) CYP3A4ALOX15SMN1; SMN2MAPTALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040038152-A1 Method for making printing plate by inkjet deposition on positive-working media CREO SRL (CA) 2004-02-26 US claimed
EP-1542871-A1 METHOD FOR MAKING PRINTING PLATE BY INKJET DEPOSITION ON POSITIVE-WORKING MEDIA Creo SRL (CA) 2005-06-22 EP disclosed
US-20040038152-A1 Method for making printing plate by inkjet deposition on positive-working media CREO SRL (CA) 2004-02-26 US disclosed
WO-2004007200-A1 METHOD FOR MAKING PRINTING PLATE BY INKJET DEPOSITION ON POSITIVE-WORKING MEDIA CREO SRL (CA) 2004-01-22 WO disclosed