SCHEMBL2083291

SCHEMBL2083291

Cc1nn2c(-c3ccc(Cl)cc3)c(-c3ccccc3Cl)cnc2c1C(=O)NCC1(N)CCCC1

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.37
NTRK1 P04629 2/20 0.37
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
PIM1 P11309 1/20 0.37
ACVR1 Q04771 1/20 0.37
CNR1 P21554 3/20 0.36
ALDH1A1 P00352 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HPGD P15428 1/20 0.34
NR3C1 P04150 1/20 0.34
MAPT P10636 1/20 0.34
P2RX7 Q99572 5/20 0.33
AKT2 P31751 1/20 0.33
AKT1 P31749 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL2083637 0.85 KMT2A (0.36) KMT2ANTRK1MEN1NPC1RAB9A
SCHEMBL2085799 0.84 CNR1 (0.37) KMT2ANTRK1MEN1NPC1RAB9A
SCHEMBL2086698 0.82 NR3C1 (0.33) KMT2ANTRK1MEN1NPC1RAB9A
SCHEMBL2083499 0.81 CNR1 (0.34) KMT2ANTRK1MEN1NPC1RAB9A
SCHEMBL2085467 0.81 CNR1 (0.41) KMT2ANTRK1MEN1NPC1RAB9A
SCHEMBL2085335 0.80 DGAT2 (0.43)
SCHEMBL2084433 0.80 CNR1 (0.32) KMT2ANTRK1MEN1NPC1RAB9A
SCHEMBL1754393 0.79 CNR2 (0.41) KMT2ANTRK1MEN1NPC1RAB9A
SCHEMBL1754318 0.78 KMT2A (0.40) KMT2ANTRK1MEN1NPC1RAB9A
SCHEMBL4109766 0.77 KDM4E (0.50) KMT2AMEN1NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8921380-B2 Pyrazolo[1,5-a] pyrimidine compounds as CB1 receptor antagonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2014-12-30 US disclosed
EP-2520577-A1 Pyrazolo[1,5-a]pyrimidine compounds as CB1 receptor antagonists Mitsubishi Tanabe Pharma Corporation (JP) 2012-11-07 EP disclosed
US-20120202992-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST TANIMOTO KOICHI (JP) 2012-08-09 US disclosed
US-8163759-B2 Pyrazolo[1,5-A] pyrimidine compounds as CB1 receptor antagonist MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-04-24 US disclosed
US-20090258867-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-10-15 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-20120202992-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST CNR1, CNR2, CCKAR KMT2A 2533/4885NTRK1 453/4885MEN1 3032/4885
US-20090258867-A1 PYRAZOLO[1,5-A] PYRIMIDINE COMPOUNDS AS CB1 RECEPTOR ANTAGONIST CNR1, CNR2, CCKAR KMT2A 2273/4885NTRK1 354/4885MEN1 3255/4885

“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.