SCHEMBL662006

SCHEMBL662006

Cc1cc(=O)oc2cc(OC(=O)c3ccccc3)ccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 1.00
ALDH1A1 P00352 11/20 1.00
GAA P10253 9/20 1.00
GLA P06280 8/20 1.00
KMT2A Q03164 6/20 1.00
MAPT P10636 3/20 1.00
NPBWR1 P48145 1/20 1.00
CA9 Q16790 3/20 0.71
F2 P00734 1/20 0.70
AR P10275 1/20 0.68
CA12 O43570 2/20 0.64
POLB P06746 1/20 0.64
HPGD P15428 6/20 0.63
HSD17B10 Q99714 2/20 0.63
IGLV6-57 P01721 3/20 0.62
NPC1 O15118 1/20 0.60
MAOA P21397 1/20 0.60
MAOB P27338 1/20 0.60
CASP3 P42574 1/20 0.60
RAB9A P51151 1/20 0.60

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
SCHEMBL4386227 0.88 KDM4E (0.79) KDM4EALDH1A1GAAGLAKMT2A
SCHEMBL27860823 0.87 KDM4E (0.77) KDM4EALDH1A1GAAGLAKMT2A
SCHEMBL26236223 0.86 KDM4E (0.74) KDM4EALDH1A1GAAGLAKMT2A
SCHEMBL29676524 0.85 KMT2A (0.74) KDM4EALDH1A1GAAGLAKMT2A
SCHEMBL27326021 0.85 ALDH1A1 (0.72) KDM4EALDH1A1GAAGLAKMT2A
SCHEMBL27326912 0.84 ALDH1A1 (0.71) KDM4EALDH1A1GAAGLAKMT2A
SCHEMBL6265592 0.83 KDM4E (0.70) KDM4EALDH1A1GAAGLAKMT2A
SCHEMBL29700876 0.82 ALDH1A1 (0.69) KDM4EALDH1A1GAAGLAKMT2A
SCHEMBL25054015 0.82 KMT2A (1.00) KDM4EALDH1A1GAAGLAKMT2A
SCHEMBL335474 0.82 KDM4E (1.00) KDM4EALDH1A1GAAGLAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5342691-A Phenyl (meth) acrylate type polymer or copolymer with UV absorber ROHM GMBH CHEMISCHE FABRIK (DE) 1994-08-30 US claimed
US-20120046238-A1 COUMARIN COMPOUNDS AND THEIR USE FOR TREATING VIRAL INFECTION NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2012-02-23 US disclosed
US-20120046238-A1 COUMARIN COMPOUNDS AND THEIR USE FOR TREATING VIRAL INFECTION NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2012-02-23 US disclosed
US-8058427-B2 Coumarin compounds and their use for treating cancer NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2011-11-15 US disclosed
US-8058427-B2 Coumarin compounds and their use for treating cancer NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2011-11-15 US disclosed
US-20090312317-A1 COUMARIN COMPOUNDS AND THEIR USE FOR TREATING CANCER NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-12-17 US disclosed
US-20090312317-A1 COUMARIN COMPOUNDS AND THEIR USE FOR TREATING CANCER NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-12-17 US disclosed
WO-2009152210-A2 COUMARIN COMPOUNDS AND THEIR USE FOR TREATING CANCER NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-12-17 WO disclosed
US-20090312406-A1 COUMARIN COMPOUNDS AND THEIR USE FOR TREATING VIRAL INFECTION NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-12-17 US disclosed
US-20090312406-A1 COUMARIN COMPOUNDS AND THEIR USE FOR TREATING VIRAL INFECTION NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-12-17 US disclosed
US-20090312406-A1 COUMARIN COMPOUNDS AND THEIR USE FOR TREATING VIRAL INFECTION NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-12-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090312406-A1 COUMARIN COMPOUNDS AND THEIR USE FOR TREATING VIRAL INFECTION C1R, CYP3A4, CYP3A7 KDM4E 3612/4885ALDH1A1 718/4885GAA 1341/4885
US-20120046238-A1 COUMARIN COMPOUNDS AND THEIR USE FOR TREATING VIRAL INFECTION C1R, CYP3A4, CYP3A7 KDM4E 3612/4885ALDH1A1 718/4885GAA 1341/4885
US-20090312317-A1 COUMARIN COMPOUNDS AND THEIR USE FOR TREATING CANCER SIRT3, CBR3, RDX KDM4E 2566/4885ALDH1A1 175/4885GAA 2378/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.