SCHEMBL4168784

SCHEMBL4168784

O=C(Nc1ccc(Cl)cc1)c1ccc(Br)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
MEN1 O00255 3/20 0.65
NPC1 O15118 2/20 0.65
RAB9A P51151 2/20 0.65
MAPT P10636 2/20 0.64
NT5E P21589 1/20 0.64
MAPK1 P28482 1/20 0.64
TP53 P04637 1/20 0.61
ALDH1A1 P00352 2/20 0.60
LMNA P02545 3/20 0.58
HTT P42858 1/20 0.58
KCNQ3 O43525 1/20 0.58
KCNQ2 O43526 1/20 0.58
KCNE1 P15382 1/20 0.58
KCNQ1 P51787 1/20 0.58
USP2 O75604 1/20 0.58
NAMPT P43490 1/20 0.58
GAA P10253 1/20 0.58
POLB P06746 1/20 0.57

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
SCHEMBL21798720 0.90 KMT2A (0.76) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL3679372 0.90 KMT2A (0.76) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL611657 0.90 NPC1 (0.76) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL10939703 0.90 NPC1 (0.76) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL9767723 0.90 NPC1 (0.76) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL674167 0.87 HDAC8 (0.69) KMT2ASMN1; SMN2NPC1RAB9ANT5E
SCHEMBL674688 0.85 HDAC6 (0.69) KMT2AMEN1MAPTTP53USP2
SCHEMBL16583981 0.83 KMT2A (0.74) KMT2AMEN1MAPTTP53USP2
SCHEMBL2461226 0.83 MAPT (0.71) KMT2ASMN1; SMN2MEN1NPC1RAB9A
SCHEMBL16592202 0.83 KMT2A (0.74) KMT2AMEN1MAPTTP53USP2

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
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
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
CN-101454327-A Azolopyrimidines as inhibitors of cannabinoid 1 activity IRM LLC (BM) 2009-06-10 CN 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 KMT2A 1626/4885SMN1; SMN2 4375/4885MEN1 3584/4885

“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.