SCHEMBL7782586

SCHEMBL7782586

CCCCCn1c(C)c(C(=O)c2ccc(Br)c3ccccc23)c2cccc(F)c21

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 19/20 0.74
CNR1 P21554 12/20 0.74
SLC6A3 Q01959 1/20 0.55

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
SCHEMBL7782582 0.86 CNR2 (0.71) CNR2CNR1SLC6A3
SCHEMBL8075118 0.82 CNR2 (0.77) CNR2CNR1
SCHEMBL7777725 0.74 CNR2 (0.71) CNR2CNR1SLC6A3
SCHEMBL29388381 0.74 CNR2 (1.00) CNR2CNR1SLC6A3
SCHEMBL29387479 0.73 CNR2 (1.00) CNR2CNR1SLC6A3
SCHEMBL6331420 0.73 CNR2 (1.00) CNR2CNR1SLC6A3
SCHEMBL8075206 0.72 CNR2 (0.80) CNR2CNR1
SCHEMBL16344141 0.71 CNR2 (1.00) CNR2CNR1SLC6A3
SCHEMBL29362163 0.71 CNR2 (1.00) CNR2CNR1SLC6A3
SCHEMBL29988949 0.71 CNR2 (1.00) CNR2CNR1SLC6A3

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
CN-1150166-C CB2 receptor agonist compounds ��ŵ�Ѻϳ�ʵ���� 2004-05-19 CN claimed
EP-0833818-B1 3-ACYLINDOLES AS CB2 RECEPTOR AGONISTS SANOFI SYNTHELABO (FR) 2001-10-17 EP claimed
EP-0833818-A1 CB 2? RECEPTOR AGONIST COMPOUNDS SANOFI (FR) 1998-04-08 EP claimed
WO-1997000860-A1 CB2 RECEPTOR AGONIST COMPOUNDS SANOFI (FR) 1997-01-09 WO claimed
US-20170240521-A1 PERIPHERALLY-ACTING CANNABINOID RECEPTOR AGONISTS FOR CHRONIC PAIN THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-08-24 US disclosed
US-9656981-B2 Peripherally-acting cannabinoid receptor agonists for chronic pain THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-05-23 US disclosed
US-20150239859-A1 PERIPHERALLY-ACTING CANNABINOID RECEPTOR AGONISTS FOR CHRONIC PAIN THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-08-27 US disclosed
EP-0833818-B1 3-ACYLINDOLES AS CB2 RECEPTOR AGONISTS SANOFI SYNTHELABO (FR) 2001-10-17 EP disclosed
US-6013648-A IMMUNOMODULATORS SANOFI (FR) 2000-01-11 US disclosed
EP-0833818-A1 CB 2? RECEPTOR AGONIST COMPOUNDS SANOFI (FR) 1998-04-08 EP disclosed
WO-1997000860-A1 CB2 RECEPTOR AGONIST COMPOUNDS SANOFI (FR) 1997-01-09 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 (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-20150239859-A1 PERIPHERALLY-ACTING CANNABINOID RECEPTOR AGONISTS FOR CHRONIC PAIN CNR2, CNR1, OPRL1 CNR2 1/4885CNR1 2/4885SLC6A3 999/4885
US-20170240521-A1 PERIPHERALLY-ACTING CANNABINOID RECEPTOR AGONISTS FOR CHRONIC PAIN CNR2, CNR1, OPRL1 CNR2 1/4885CNR1 2/4885SLC6A3 999/4885

“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.