SCHEMBL2980713

SCHEMBL2980713

COc1ccc(NC2=C(Cl)C(=O)CC2)cc1OC1CCCC1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
PDE4D Q08499 14/20 0.49
PDE4B Q07343 14/20 0.49
PDE4A P27815 13/20 0.49
PDE4C Q08493 12/20 0.49
EPHA2 P29317 1/20 0.44
KDR P35968 1/20 0.44
EPHB4 P54760 1/20 0.44

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
SCHEMBL2964920 0.87 POLB (0.54) POLBPDE4DPDE4BPDE4APDE4C
SCHEMBL2980274 0.86 POLB (0.53) POLBPDE4DPDE4BPDE4APDE4C
SCHEMBL2974599 0.86 POLB (0.53) POLBPDE4DPDE4BPDE4APDE4C
SCHEMBL2971133 0.84 POLB (0.54) POLBPDE4DPDE4BPDE4APDE4C
SCHEMBL2978242 0.81 POLB (0.51) POLBPDE4DPDE4BPDE4APDE4C
SCHEMBL2979438 0.81 POLB (0.53) POLBPDE4DPDE4BPDE4APDE4C
SCHEMBL2981478 0.81 POLB (0.52) POLBPDE4DPDE4BPDE4APDE4C
SCHEMBL2966399 0.80 PDE4A (0.50) POLBPDE4DPDE4BPDE4APDE4C
SCHEMBL1157647 0.79 POLB (0.57) POLBPDE4DPDE4BPDE4APDE4C
SCHEMBL2976701 0.78 POLB (0.57) POLBPDE4DPDE4BPDE4APDE4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7772258-B2 Agent for treatment of allergic eye disease NIKKEN CHEMICALS CO., LTD. (JP) 2010-08-10 US disclosed
US-20080306163-A1 AGENT FOR TREATMENT OF ALLERGIC EYE DISEASE NIKKEN CHEMICALS CO., LTD. 2008-12-11 US disclosed
EP-0994100-B1 3-ANILINO-2-CYCLOALKENONE DERIVATES NIKKEN CHEMICALS CO LTD (JP) 2006-08-30 EP disclosed
US-20040220227-A1 Remedies for allergic eye diseases NIKKEN CHEMICALS CO., LTD. (JP) 2004-11-04 US disclosed
EP-1410795-A1 REMEDIES FOR ALLERGIC EYE DISEASES Nikken Chemicals Company, Limited (JP) 2004-04-21 EP disclosed
US-6235736-B1 ANTIINFLAMMATORY AGENTS NIKKEN CHEMICALS CO., LTD. (JP) 2001-05-22 US disclosed
EP-0994100-A1 3-ANILINO-2-CYCLOALKENONE DERIVATES Nikken Chemicals Company, Limited (JP) 2000-04-19 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 (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-20040220227-A1 Remedies for allergic eye diseases HRH2, HRH1, HRH4 POLB 4761/4885PDE4D 2881/4885PDE4B 2290/4885
US-20080306163-A1 AGENT FOR TREATMENT OF ALLERGIC EYE DISEASE HRH4, HRH3, HRH2 POLB 4701/4885PDE4D 2841/4885PDE4B 2422/4885

“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.