SCHEMBL9903573

SCHEMBL9903573

Fc1ccc(C#Cc2cnc3ncsc3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 12/20 0.39
EGLN1 Q9GZT9 3/20 0.39
EGLN3 Q9H6Z9 1/20 0.37
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNA4 P43681 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
SCHEMBL9903909 0.86 GRM5 (0.40) GRM5CHRNB2CHRNA4
SCHEMBL9903885 0.84 NPC1 (0.35) GRM5NPC1RAB9A
SCHEMBL9903745 0.84 GRM5 (0.46) GRM5CHRNB2
SCHEMBL9903562 0.84 GRM5 (0.35) GRM5NPC1RAB9A
SCHEMBL9902620 0.84 GRM5 (0.45) GRM5EGLN1
SCHEMBL9902877 0.84 GRM5 (0.46) GRM5
SCHEMBL9902975 0.83 GRM5 (0.37) GRM5
SCHEMBL9903659 0.81 GRM5 (0.45) GRM5
SCHEMBL9903639 0.81 BRAF (0.39) NPC1RAB9A
SCHEMBL9903458 0.80 CHRNB2 (0.40) GRM5NPC1RAB9ACHRNB2CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120178742-A1 METABOTROPIC GLUTAMATE RECEPTOR MODULATORS MERZ PHARMA GMBH & CO. KGAA (DE) 2012-07-12 US claimed
EP-2462142-A1 METABOTROPIC GLUTAMATE RECEPTOR MODULATORS Merz Pharma GmbH & Co. KGaA (DE) 2012-06-13 EP claimed
US-20120178742-A1 METABOTROPIC GLUTAMATE RECEPTOR MODULATORS MERZ PHARMA GMBH & CO. KGAA (DE) 2012-07-12 US disclosed
EP-2462142-A1 METABOTROPIC GLUTAMATE RECEPTOR MODULATORS Merz Pharma GmbH & Co. KGaA (DE) 2012-06-13 EP 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-20120178742-A1 METABOTROPIC GLUTAMATE RECEPTOR MODULATORS GRM5, GRIK5, GRM1 GRM5 1/4885EGLN1 3534/4885EGLN3 3003/4885

“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.