SCHEMBL4789677

SCHEMBL4789677

O=C(c1cc2ncc(Cl)cn2n1)N1CC=C(c2ccccc2Cl)CC1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 13/20 0.53
SCD O00767 1/20 0.45
SCD5 Q86SK9 1/20 0.45
ALDH1A1 P00352 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TDP1 Q9NUW8 2/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ESR2 Q92731 2/20 0.41
TSHR P16473 1/20 0.41
ESR1 P03372 1/20 0.41
POLB P06746 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL4758400 0.90 GRM5 (0.56) GRM5SCDSCD5ALDH1A1SMN1; SMN2
SCHEMBL4790586 0.90 GRM5 (0.52) GRM5ALDH1A1TDP1GAAMAPT
SCHEMBL4788098 0.90 GRM5 (0.52) GRM5SCDSCD5ALDH1A1SMN1; SMN2
SCHEMBL4789883 0.90 GRM5 (0.56) GRM5ALDH1A1TDP1GAAMAPT
SCHEMBL8217851 0.89 GRM5 (0.56) GRM5SCDSCD5ALDH1A1SMN1; SMN2
SCHEMBL4788612 0.88 GRM5 (0.49) GRM5SCDSCD5ALDH1A1SMN1; SMN2
SCHEMBL4789680 0.87 GRM5 (0.49) GRM5SCDSCD5ALDH1A1SMN1; SMN2
SCHEMBL5122361 0.86 GRM5 (0.57) GRM5ALDH1A1SMN1; SMN2TDP1GAA
SCHEMBL4790657 0.85 GRM5 (0.52) GRM5ALDH1A1SMN1; SMN2TDP1GAA
SCHEMBL5110265 0.84 GRM5 (0.53) GRM5ALDH1A1SMN1; SMN2TDP1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008015271-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THE USE AS A MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2008-02-07 WO claimed
US-20080032998-A1 Pyrazolopyrimidines, a process for their preparation and their use as medicine MERZ PHARMA GMBH & CO. KGAA (DE) 2008-02-07 US claimed
WO-2008015271-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THE USE AS A MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2008-02-07 WO disclosed
US-20080032998-A1 Pyrazolopyrimidines, a process for their preparation and their use as medicine MERZ PHARMA GMBH & CO. KGAA (DE) 2008-02-07 US disclosed
US-20080032998-A1 Pyrazolopyrimidines, a process for their preparation and their use as medicine MERZ PHARMA GMBH & CO. KGAA (DE) 2008-02-07 US disclosed
US-20080032998-A1 Pyrazolopyrimidines, a process for their preparation and their use as medicine MERZ PHARMA GMBH & CO. KGAA (DE) 2008-02-07 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 (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-20080032998-A1 Pyrazolopyrimidines, a process for their preparation and their use as medicine GRM5, GRM1, GRIK5 GRM5 1/4885SCD 4633/4885SCD5 2821/4885

“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.