SCHEMBL2635928

SCHEMBL2635928

COc1cccc2ccc(=O)oc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 1.00
MCL1 Q07820 3/20 0.62
CA9 Q16790 8/20 0.58
CA12 O43570 6/20 0.56
CA1 P00915 6/20 0.56
CA7 P43166 5/20 0.56
KDM4E B2RXH2 5/20 0.56
CA13 Q8N1Q1 4/20 0.56
ALDH1A1 P00352 4/20 0.56
HPGD P15428 3/20 0.56
HSD17B10 Q99714 2/20 0.56
CA2 P00918 3/20 0.54
KMT2A Q03164 3/20 0.54
MAPT P10636 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MEN1 O00255 2/20 0.54
CYP2C9 P11712 1/20 0.54
ALOX15 P16050 1/20 0.54
MAPK1 P28482 1/20 0.54
CASP1 P29466 1/20 0.54

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
SCHEMBL23114207 0.89 CYP2A6 (0.79) CYP2A6MCL1CA9CA12CA1
SCHEMBL15842328 0.82 CYP2A6 (0.70) CYP2A6MCL1CA9CA12CA1
SCHEMBL16283614 0.81 CYP2A6 (0.68) CYP2A6MCL1CA9CA12CA1
SCHEMBL11033454 0.81 CYP2A6 (0.68) CYP2A6CA9CA12CA1CA7
SCHEMBL15842762 0.81 CYP2A6 (0.68) CYP2A6MCL1CA9CA12CA1
SCHEMBL16283609 0.80 CYP2A6 (0.66) CYP2A6MCL1CA9CA12KDM4E
SCHEMBL3362753 0.78 CA9 (0.70) CYP2A6MCL1CA9CA12CA1
SCHEMBL4181037 0.78 MCL1 (0.67) CYP2A6MCL1CA9CA12CA1
SCHEMBL15842592 0.77 CYP2A6 (0.63) CYP2A6MCL1CA9CA12CA1
SCHEMBL15842313 0.77 CYP2A6 (0.62) CYP2A6MCL1CA9CA12CA1

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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110283180-B Method for synthesizing pyridine [3,4-c ] coumarin 长沙理工大学 2022-03-29 CN claimed
US-9127092-B2 Method for producing polydienes and polydiene copolymers with reduced cold flow BRIDGESTONE CORPORATION (JP) 2015-09-08 US claimed
US-20140187725-A1 METHOD FOR PRODUCING POLYDIENES AND POLYDIENE COPOLYMERS WITH REDUCED COLD FLOW BRIDGESTONE CORPORATION (JP) 2014-07-03 US claimed
CN-110283180-B Method for synthesizing pyridine [3,4-c ] coumarin 长沙理工大学 2022-03-29 CN disclosed
US-10633369-B2 Method of inhibiting DYRK1B 4 SC AG (DE) 2020-04-28 US disclosed
CN-110317226-A Silane coupling compound and medical courses in general curable composition for dental applications containing them 株式会社松风 2019-10-11 CN disclosed
CN-106674175-B The synthetic method of coumarin kind compound 西交利物浦大学 2019-03-26 CN disclosed
US-20180201606-A1 METHOD OF INHIBITING DYRK1B 4 SC AG (DE) 2018-07-19 US disclosed
US-9951050-B2 Method of inhibiting DYRK1B 4 SC AG (DE) 2018-04-24 US disclosed
EP-2813891-B1 Photoresist underlayer film-forming composition and pattern forming process SHINETSU CHEMICAL CO (JP) 2018-01-17 EP disclosed
EP-2438078-B1 NOVOBIOCIN ANALOGUES HAVING MODIFIED SUGAR MOIETIES UNIV KANSAS (US) 2017-10-25 EP disclosed
EP-0942911-A1 BENZOPYRANOPYRROLE AND BENZOPYRANOPYRIDINE ALPHA-1 ADRENERGIC COMPOUNDS Abbott Laboratories (US) 1999-09-22 EP disclosed
US-5891882-A TREATING BENIGN PROSTATIC HYPERPLASIA OR OTHER UROLOGICAL DISEASES SUCH AS BLADDER OUTLET OBSTRUCTION AND NEUROGENIC BLADDER, OR GYNECOLOGICAL SYNDROMES SUCH AS DYSMENORRHEA ABBOTT LABORATORIES (US) 1999-04-06 US disclosed
US-5808105-A 4-phenoxycoumarins as herbicidal agents AMERICAN CYANAMID COMPANY (US) 1998-09-15 US disclosed
WO-1998024791-A1 BENZOPYRANOPYRROLE AND BENZOPYRANOPYRIDINE ALPHA-1 ADRENERGIC COMPOUNDS ABBOTT LABORATORIES (US) 1998-06-11 WO disclosed
US-5759959-A SELECTIVE CONTROL OF MONOCOTYLEDENOUS WEEDS IN THE PRESENCE OF A CROP PLANT AMERICAN CYANAMID COMPANY (US) 1998-06-02 US disclosed
US-5681968-A EFFECTIVE TO CONTROL GRASS AND OTHER MONOCOTOLYDENOUS WEEDS AMERICAN CYANAMID COMPANY (US) 1997-10-28 US disclosed
US-5563280-A CONTROLLING MONOCOTYLEDENOUS WEEDS IN CROPS AMERICAN CYANAMID CO. (US) 1996-10-08 US disclosed
EP-0694257-A1 4-Phenoxycoumarins and thio derivatives thereof, their preparation and use as herbicides AMERICAN CYANAMID COMPANY (US) 1996-01-31 EP disclosed
US-4441969-A ARYL HYDROXY CARBOXYLIC ACID OMI INTERNATIONAL CORPORATION (US) 1984-04-10 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 (2 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-10633369-B2 Method of inhibiting DYRK1B SMO, GLI1, GRK2 CYP2A6 4696/4885MCL1 748/4885CA9 2105/4885
US-20180201606-A1 METHOD OF INHIBITING DYRK1B SMO, GLI1, GRK2 CYP2A6 4696/4885MCL1 748/4885CA9 2105/4885

“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.