SCHEMBL4172288

SCHEMBL4172288

Nc1ccc(-c2ccc(-c3nc4c(cnn4-c4cccc(-c5nnn[nH]5)c4)c(=O)n3-c3ccc(Cl)cc3)cc2)nc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.52
GRM1 Q13255 7/20 0.47
TP53 P04637 3/20 0.47
THRB P10828 1/20 0.45
SMN1; SMN2 Q16637 5/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
KMT2A Q03164 2/20 0.43
GRM5 P41594 1/20 0.43
TSHR P16473 1/20 0.41
HTT P42858 1/20 0.41
PTGS2 P35354 1/20 0.40
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL4171566 0.88 MAPT (0.53) MAPTGRM1TP53THRBSMN1; SMN2
SCHEMBL4164601 0.82 GRM1 (0.67) MAPTGRM1TP53THRBSMN1; SMN2
SCHEMBL4157160 0.82 MAPT (0.54) MAPTGRM1TP53THRBSMN1; SMN2
SCHEMBL4164801 0.82 GRM1 (0.59) MAPTGRM1TP53THRBSMN1; SMN2
SCHEMBL4163363 0.82 MAPT (0.53) MAPTGRM1TP53THRBSMN1; SMN2
SCHEMBL4166802 0.80 MAPT (0.53) MAPTGRM1TP53THRBSMN1; SMN2
SCHEMBL27744844 0.80 MAPT (0.51) MAPTGRM1TP53THRBSMN1; SMN2
SCHEMBL4180742 0.79 GRM1 (0.56) MAPTGRM1TP53THRBSMN1; SMN2
SCHEMBL1753270 0.75 GRM1 (0.66) MAPTGRM1TP53THRBSMN1; SMN2
SCHEMBL4167536 0.74 MAPT (0.64) MAPTGRM1TP53THRBSMN1; SMN2

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-8722691-B2 Azolopyrimidines as inhibitors of cannabinoid 1 activity IRM LLC (BM) 2014-05-13 US claimed
EP-1999132-B1 AZOLOPYRIMIDINES AS INHIBITORS OF CANNABINOID 1 ACTIVITY IRM LLC (BM) 2012-07-18 EP claimed
US-20090247556-A1 Azolopyrimidines as Inhibitors of Cannabinoid 1 Activity IRM LLC (BM) 2009-10-01 US claimed
US-8722691-B2 Azolopyrimidines as inhibitors of cannabinoid 1 activity IRM LLC (BM) 2014-05-13 US disclosed
US-8722691-B2 Azolopyrimidines as inhibitors of cannabinoid 1 activity IRM LLC (BM) 2014-05-13 US disclosed
US-8722691-B2 Azolopyrimidines as inhibitors of cannabinoid 1 activity IRM LLC (BM) 2014-05-13 US disclosed
EP-1999132-B1 AZOLOPYRIMIDINES AS INHIBITORS OF CANNABINOID 1 ACTIVITY IRM LLC (BM) 2012-07-18 EP disclosed
US-20090247556-A1 Azolopyrimidines as Inhibitors of Cannabinoid 1 Activity IRM LLC (BM) 2009-10-01 US disclosed
US-20090247556-A1 Azolopyrimidines as Inhibitors of Cannabinoid 1 Activity IRM LLC (BM) 2009-10-01 US disclosed
US-20090247556-A1 Azolopyrimidines as Inhibitors of Cannabinoid 1 Activity IRM LLC (BM) 2009-10-01 US disclosed
EP-1999132-A1 AZOLOPYRIMIDINES AS INHIBITORS OF CANNABINOID 1 ACTIVITY IRM, LLC (BM) 2008-12-10 EP disclosed
WO-2007120454-A1 AZOLOPYRIMIDINES AS INHIBITORS OF CANNABINOID 1 ACTIVITY IRM LLC (BM) 2007-10-25 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 (1 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-20090247556-A1 Azolopyrimidines as Inhibitors of Cannabinoid 1 Activity CNR1, CNR2, ITPR2 MAPT 2577/4885GRM1 424/4885TP53 2988/4885

“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.