SCHEMBL6607890

SCHEMBL6607890

CCOC1CC1(C#N)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.34
PDE4B Q07343 2/20 0.34
PDE4C Q08493 2/20 0.34
PDE4D Q08499 2/20 0.34
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
MAPT P10636 1/20 0.30
ALOX15 P16050 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7713090 0.83 ALDH1A1 (0.33) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL668926 0.76 CYP3A4 (0.32) PDE4APDE4BPDE4CPDE4D
SCHEMBL3549256 0.73 APLNR (0.32)
SCHEMBL669391 0.72 MAPT (0.35) KDM4EMEN1MAPTALOX15KMT2A
SCHEMBL670372 0.72
SCHEMBL24868147 0.70
SCHEMBL4645147 0.70
SCHEMBL669585 0.68 USP2 (0.33) MAPT
SCHEMBL3958433 0.67 GRM2 (0.32)
SCHEMBL3958437 0.67 GRM2 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11759454-B2 Diazole lactams CHEMOCENTRYX, INC. (US) 2023-09-19 US disclosed
US-20210093613-A1 DIAZOLE LACTAMS CHEMOCENTRYX, INC. 2021-04-01 US disclosed
US-10744118-B2 Diazole lactams CHEMOCENTRYX, INC. (US) 2020-08-18 US disclosed
EP-2928474-B1 DIAZOLE LACTAMS CHEMOCENTRYX INC (US) 2018-11-14 EP disclosed
US-20160303084-A1 DIAZOLE LACTAMS CHEMOCENTRYX, INC. 2016-10-20 US disclosed
EP-2928474-A1 DIAZOLE LACTAMS ChemoCentryx, Inc. (US) 2015-10-14 EP disclosed
WO-2014089495-A1 DIAZOLE LACTAMS CHEMOCENTRYX, INC. (US) 2014-06-12 WO disclosed
EP-0971588-B1 NOVEL CANNABINOID RECEPTOR MODULATORS SMITHKLINE BEECHAM CORP (US) 2004-03-17 EP disclosed
EP-0971588-A4 NOVEL CANNABINOID RECEPTOR MODULATORS SMITHKLINE BEECHAM CORP (US) 2000-12-27 EP disclosed
US-6100259-A 1-(DISUBSTITUTED PHENYL)4,5-SUBSTITUTED PYRAZOLE DERIVATIVES OF GIVEN FORMULA; ANTAGONIZING CANNABINOID 2 RECEPTORS; TREATING RHEUMATOID ARTHRITIS, SYSTEMIC LUPUS ERYTHEMATOSUS, PSORIASIS, MULTIPLE SCLEROSIS, DIABETES AND THYROIDITIS SMITHKLINE BEECHAM CORPORATION (US) 2000-08-08 US disclosed
EP-0971588-A1 NOVEL CANNABINOID RECEPTOR MODULATORS SMITHKLINE BEECHAM CORPORATION (US) 2000-01-19 EP disclosed
WO-1998031227-A1 NOVEL CANNABINOID RECEPTOR MODULATORS SMITHKLINE BEECHAM CORPORATION (US) 1998-07-23 WO 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 (4 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-20160303084-A1 DIAZOLE LACTAMS CCR1, CCRL2, CCR4 PDE4A 1403/4885PDE4B 1437/4885PDE4C 1973/4885
US-20210093613-A1 DIAZOLE LACTAMS CCR1, CCRL2, CCR4 PDE4A 1403/4885PDE4B 1437/4885PDE4C 1973/4885
US-10744118-B2 Diazole lactams CCR1, CCRL2, CCR4 PDE4A 1403/4885PDE4B 1437/4885PDE4C 1973/4885
US-11759454-B2 Diazole lactams CCR1, CCRL2, CCR4 PDE4A 1403/4885PDE4B 1437/4885PDE4C 1973/4885

“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.