SCHEMBL1009053

SCHEMBL1009053

CC1NCCc2c1ccc1c2ccn1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.34
KDM4E B2RXH2 4/20 0.34
HSD17B10 Q99714 3/20 0.34
DRD2 P14416 2/20 0.34
TSHR P16473 2/20 0.34
CYP2C9 P11712 1/20 0.34
DRD3 P35462 1/20 0.34
HIF1A Q16665 1/20 0.34
DRD4 P21917 1/20 0.34
MAPT P10636 3/20 0.33
ALDH1A1 P00352 2/20 0.33
HTR2B P41595 1/20 0.33
PSMD14 O00487 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
HTR2A P28223 2/20 0.32
HTR2C P28335 2/20 0.32
ACHE P22303 1/20 0.32
RHEB Q15382 1/20 0.31
ALOX15 P16050 1/20 0.31

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
SCHEMBL7416358 0.71 NOTUM (0.41) KDM4EHSD17B10DRD2DRD4MAPT
SCHEMBL1009954 0.68 HTR2B (0.50) MAOAKDM4EHSD17B10DRD2TSHR
SCHEMBL1010830 0.67 PARP1 (0.42) MAOAKDM4EHSD17B10DRD2TSHR
SCHEMBL17681818 0.66 GID4 (0.61) MAOAKDM4EHSD17B10DRD2TSHR
SCHEMBL1010578 0.66 HTR2C (0.61) MAOAKDM4EHSD17B10DRD2TSHR
SCHEMBL24548614 0.66 MAOA (0.39) MAOAKDM4EHSD17B10DRD2TSHR
SCHEMBL29607730 0.66 GID4 (0.61) MAOAKDM4EHSD17B10DRD2TSHR
SCHEMBL7993624 0.66 GID4 (0.61) MAOAKDM4EHSD17B10DRD2TSHR
SCHEMBL23112119 0.66 MAOA (0.39) MAOAKDM4EHSD17B10DRD2TSHR
SCHEMBL1010725 0.66 MEN1 (0.39) MAOAKDM4EHSD17B10DRD2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110212956-A1 Pyrazolopyrimidines for treating CNS disorders MERZ PHARMA GMBH & CO. KGAA (DE) 2011-09-01 US disclosed
US-7985753-B2 Substituted pyrazolo[1,5-A]pyrimidines as metabotropic glutamate receptor modulators MERZ PHARMA GMBH & CO. KGAA (DE) 2011-07-26 US disclosed
EP-2295439-A1 Substituted pyrazolopyrimidines, a process for their preparation and their use as medicine Merz Pharma GmbH & Co. KGaA (DE) 2011-03-16 EP disclosed
EP-2054416-B1 SUBSTITUTED PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE MERZ PHARMA GMBH & CO KGAA (DE) 2011-01-05 EP disclosed
EP-2090576-A1 6-halo-pyrazolo[1,5-a]pyridines, a process for their preparation and their use as metabotropic glutamate receptor (mGluR) modulators Merz Pharma GmbH & Co.KGaA (DE) 2009-08-19 EP disclosed
WO-2009095253-A1 6-HALO-PYRAZOLO[1, 5-A]PYRIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR (MGLUR) MODULATORS MERZ PHARMA GMBH & CO. KGAA (DE) 2009-08-06 WO disclosed
EP-2054416-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE Merz Pharma GmbH & Co. KGaA (DE) 2009-05-06 EP disclosed
US-20080039458-A1 Substituted pyrazolopyrimidines, a process for their preparation and their use as medicine MERZ PHARMA GMBH & CO. KGAA (DE) 2008-02-14 US disclosed
WO-2008015269-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2008-02-07 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 (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-20110212956-A1 Pyrazolopyrimidines for treating CNS disorders GRM5, GRM3, GRM1 MAOA 3070/4885KDM4E 1101/4885HSD17B10 2220/4885
US-20080039458-A1 Substituted pyrazolopyrimidines, a process for their preparation and their use as medicine GRM5, GRM1, GRM3 MAOA 2896/4885KDM4E 1357/4885HSD17B10 2614/4885

“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.