SCHEMBL2321334

SCHEMBL2321334

Cc1nccn2c(C3CCC(C(Cc4ccccc4)NC(=O)O)CC3)nc(Br)c12

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.39
IGF1R P08069 5/20 0.38
TNK2 Q07912 12/20 0.37
BTK Q06187 2/20 0.36
PDPK1 O15530 1/20 0.35
ABL1 P00519 1/20 0.35
EGFR P00533 1/20 0.35
RAF1 P04049 1/20 0.35
INSR P06213 1/20 0.35
SRC P12931 1/20 0.35
KDR P35968 1/20 0.35
MAP2K1 Q02750 1/20 0.35

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
SCHEMBL2321328 1.00 CNR2 (0.39) CNR2IGF1RTNK2BTKPDPK1
SCHEMBL2326851 0.84 TNK2 (0.37) CNR2IGF1RTNK2
SCHEMBL2322788 0.83 IDO1 (0.39) CNR2TNK2BTK
SCHEMBL2322796 0.83 IDO1 (0.39) CNR2TNK2BTK
SCHEMBL2327527 0.82 CNR2 (0.41) CNR2IGF1RTNK2
SCHEMBL2327535 0.82 CNR2 (0.41) CNR2IGF1RTNK2
SCHEMBL2321330 0.77 TNK2 (0.42) IGF1RTNK2PDPK1ABL1EGFR
SCHEMBL2327642 0.76 CNR2 (0.40) CNR2IGF1R
SCHEMBL2327637 0.76 CNR2 (0.40) CNR2IGF1R
SCHEMBL14118213 0.76 IGF1R (0.45) IGF1RTNK2BTKPDPK1ABL1

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 2049/4885IGF1R 627/4885TNK2 142/4885

“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.