SCHEMBL1753263

SCHEMBL1753263

CN(C)c1ccc(-n2cnc3c(=O)n(-c4ccc(Cl)cc4)c(-c4ccc(Cl)cc4Cl)nc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 13/20 0.45
CNR2 P34972 8/20 0.45
MCHR1 Q99705 1/20 0.45
KCNH2 Q12809 2/20 0.43
XDH P47989 1/20 0.41
F2RL3 Q96RI0 1/20 0.39
TNKS O95271 1/20 0.39
GRM1 Q13255 2/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
PTPN7 P35236 1/20 0.38
KMT2A Q03164 1/20 0.38
GRM5 P41594 1/20 0.38

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
SCHEMBL1689114 0.88 CNR1 (0.45) CNR1CNR2MCHR1KCNH2XDH
SCHEMBL1753298 0.87 F2RL3 (0.46) CNR1CNR2KCNH2XDHF2RL3
SCHEMBL1689003 0.85 CNR1 (0.47) CNR1CNR2KCNH2XDH
SCHEMBL1753305 0.85 CNR1 (0.45) CNR1CNR2MCHR1KCNH2XDH
SCHEMBL1689117 0.84 CNR1 (0.46) CNR1CNR2KCNH2XDHF2RL3
SCHEMBL1753304 0.84 CNR1 (0.45) CNR1CNR2MCHR1KCNH2LMNA
SCHEMBL1753407 0.84 CNR1 (0.44) CNR1CNR2KCNH2F2RL3TNKS
SCHEMBL1753248 0.84 CNR1 (0.44) CNR1CNR2KCNH2XDHF2RL3
SCHEMBL1753306 0.83 CNR1 (0.45) CNR1CNR2KCNH2XDHF2RL3
SCHEMBL1688899 0.82 GRM1 (0.45) CNR1CNR2KCNH2XDHTNKS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120225869-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2012-09-06 US claimed
US-20090247517-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2009-10-01 US claimed
US-20120225869-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2012-09-06 US disclosed
US-20120225869-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2012-09-06 US disclosed
US-20120225869-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2012-09-06 US disclosed
US-8158634-B2 Compounds and compositions as inhibitors of cannabinoid receptor 1 activity IRM LLC (BM) 2012-04-17 US disclosed
US-8158634-B2 Compounds and compositions as inhibitors of cannabinoid receptor 1 activity IRM LLC (BM) 2012-04-17 US disclosed
US-20090247517-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2009-10-01 US disclosed
US-20090247517-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY IRM LLC (BM) 2009-10-01 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-20120225869-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY CNR1, CNR2, FAAH CNR1 1/4885CNR2 2/4885MCHR1 551/4885
US-20090247517-A1 COMPOUNDS AND COMPOSITIONS AS INHIBITORS OF CANNABINOID RECEPTOR 1 ACTIVITY CNR1, CNR2, FAAH CNR1 1/4885CNR2 2/4885MCHR1 551/4885

“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.