SCHEMBL2327642

SCHEMBL2327642

O=C(O)NC(Cc1ccccc1)C1CCC(c2ncc3c(Cl)nccn23)CC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.40
PDE1C Q14123 6/20 0.39
PDE1B Q01064 6/20 0.39
PDE1A P54750 5/20 0.39
HTT P42858 1/20 0.38
CAPN1 P07384 4/20 0.35
RIPK1 Q13546 2/20 0.34
HDAC8 Q9BY41 1/20 0.34
ACE P12821 1/20 0.33
IGF1R P08069 2/20 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
SCHEMBL2327637 1.00 CNR2 (0.40) CNR2PDE1CPDE1BPDE1AHTT
SCHEMBL2327527 0.90 CNR2 (0.41) CNR2PDE1CPDE1BPDE1ACAPN1
SCHEMBL2327535 0.90 CNR2 (0.41) CNR2PDE1CPDE1BPDE1ACAPN1
SCHEMBL2321328 0.76 CNR2 (0.39) CNR2IGF1R
SCHEMBL2321334 0.76 CNR2 (0.39) CNR2IGF1R
SCHEMBL593254 0.75 PDE1C (0.38) PDE1CPDE1BPDE1AHTTIGF1R
SCHEMBL593256 0.75 PDE1C (0.38) PDE1CPDE1BPDE1AHTTIGF1R
SCHEMBL593236 0.75 SMN1; SMN2 (0.50) HTT
SCHEMBL1129460 0.75 TNK2 (0.57) IGF1R
SCHEMBL3179988 0.74 PDE1C (0.40) CNR2PDE1CPDE1BPDE1AIGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8658794-B2 8-methyl-1-phenyl-imidazol[1,5-a]pyrazine compounds as Lck inhibitors and uses thereof MERCK SHARP & DOHME B.V. (NL) 2014-02-25 US disclosed
US-20120309966-A1 8-METHYL-1-PHENYL-IMIDAZOL[1,5-A]PYRAZINE COMPOUNDS N.V. ORGANON (NL) 2012-12-06 US disclosed
WO-2011095556-A1 8-METHYL-1-PHENYL-IMIDAZOL[1,5-A]PYRAZINE COMPOUNDS N.V. ORGANON (NL) 2011-08-11 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-20120309966-A1 8-METHYL-1-PHENYL-IMIDAZOL[1,5-A]PYRAZINE COMPOUNDS LCK, ZAP70, FYN CNR2 2049/4885PDE1C 951/4885PDE1B 900/4885

“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.