SCHEMBL4867511

SCHEMBL4867511

COC(=O)Oc1ccccc1O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.61
▸ HPGD P15428 3/20 0.61
▸ HSD17B10 Q99714 3/20 0.61
▸ CA1 P00915 3/20 0.56
▸ TSHR P16473 2/20 0.56
▸ CA2 P00918 2/20 0.56
▸ TP53 P04637 2/20 0.56
▸ LMNA P02545 3/20 0.48
▸ MAPT P10636 4/20 0.47
▸ GAA P10253 3/20 0.47
▸ CA12 O43570 2/20 0.47
▸ CA7 P43166 2/20 0.47
▸ CA14 Q9ULX7 2/20 0.47
▸ JAK2 O60674 1/20 0.47
▸ CA9 Q16790 1/20 0.47
▸ POLB P06746 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ CYP3A4 P08684 1/20 0.43

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
SCHEMBL5683898 0.87 GAA (0.54) KDM4EHPGDHSD17B10CA1TSHR
SCHEMBL11925422 0.87 KDM4E (0.70) KDM4EHPGDHSD17B10CA1TSHR
SCHEMBL4395967 0.82 TSHR (0.62) KDM4EHPGDHSD17B10CA1TSHR
SCHEMBL688754 0.81 GAA (0.54) KDM4EHPGDHSD17B10CA1TSHR
SCHEMBL6254697 0.81 KDM4E (0.63) KDM4EHPGDHSD17B10TSHRTP53
SCHEMBL982771 0.81 HSD17B10 (0.63) KDM4EHPGDHSD17B10CA1CA2
SCHEMBL1598495 0.79 HPGD (0.61) KDM4EHPGDHSD17B10LMNAKMT2A
SCHEMBL29315376 0.79 KDM4E (0.61) KDM4EHPGDHSD17B10TSHRLMNA
SCHEMBL3910917 0.79 CA1 (0.52) CA1TSHRCA2TP53LMNA
SCHEMBL27554863 0.79 GAA (0.47) KDM4EHPGDHSD17B10CA1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100519671-C Film-forming polymer and antifouling paint JOTUN AS (NO) 2009-07-29 — — CN disclosed
US-7319101-B2 COMT inhibitors for the treatment of depression and impaired cognition HOFFMANN-LA ROCHE INC. (US) 2008-01-15 — — US disclosed
EP-1697394-B1 COMT INHIBITORS HOFFMANN LA ROCHE (CH) 2007-03-21 — — EP disclosed
EP-1697394-A2 COMT INHIBITORS F.HOFFMANN-LA ROCHE AG (CH) 2006-09-06 — — EP disclosed
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 — — CN disclosed
WO-2005058228-A2 COMT INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2005-06-30 — — WO disclosed
US-20050137162-A1 New COMT inhibitors for the treatment of depression and impaired cognition F. HOFFMANN-LA ROCHE AG (CH) 2005-06-23 — — US disclosed
US-6197918-B1 INTERCHANGE REACTION OF DIALKYL CARBONATE AND AROMATIC ALCOHOL; CATALYSIS WITH TITANIUM HALIDE, ALKOXIDE, ARYLOXIDE, OR ACETOXIDE GENERAL ELECTRIC COMPANY 2001-03-06 — — US disclosed
CN-1159442-A Method for preparation aromatic carbonic ether GEN ELECTRIC (US) 1997-09-17 — — CN disclosed
CN-1030073-C Process for continuous production of aryl carbonate ASAHI CHEMICAL IND (JP) 1995-10-18 — — CN disclosed
EP-0461274-B1 PROCESS FOR CONTINUOUSLY PRODUCING AROMATIC CARBONATE ASAHI CHEMICAL IND (JP) 1994-06-15 — — EP disclosed
US-5210268-A Ester interchange, catalysis ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1993-05-11 — — US disclosed
CN-1064677-A PROCESS FOR PREPARING AROMATIC CARBONATE ASAHI CHEMICAL IND (JP) 1992-09-23 — — CN disclosed
EP-0461274-A1 PROCESS FOR CONTINUOUSLY PRODUCING AROMATIC CARBONATE Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1991-12-18 — — EP 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 (1 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-20050137162-A1 New COMT inhibitors for the treatment of depression and impaired cognition COMT, MAOB, TPH1 KDM4E 1075/4885HPGD 544/4885HSD17B10 193/4885

“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.

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