SCHEMBL928281

SCHEMBL928281

O=C(c1cc2ncc(Cl)cn2n1)N1CCn2c(-c3cccnc3F)cnc2C1

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 5/20 0.49
P2RX7 Q99572 14/20 0.46
ALDH1A1 P00352 1/20 0.42
ESR1 P03372 1/20 0.42
POLB P06746 1/20 0.42
ESR2 Q92731 1/20 0.42

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
SCHEMBL930486 0.90 ALDH1A1 (0.54) GRM5P2RX7ALDH1A1ESR1POLB
SCHEMBL930232 0.88 P2RX7 (0.49) GRM5P2RX7
SCHEMBL3810587 0.88 P2RX7 (0.46) P2RX7
SCHEMBL929504 0.84 GRM5 (0.47) GRM5P2RX7ALDH1A1ESR1POLB
SCHEMBL927731 0.83 P2RX7 (0.49) GRM5P2RX7ALDH1A1ESR1POLB
SCHEMBL3817796 0.82 P2RX7 (0.41) GRM5P2RX7ALDH1A1ESR1POLB
SCHEMBL928699 0.80 GRM5 (0.41) GRM5P2RX7ALDH1A1ESR1POLB
SCHEMBL927967 0.79 GRM5 (0.56) GRM5P2RX7ALDH1A1ESR1POLB
SCHEMBL928023 0.78 ALDH1A1 (0.54) GRM5P2RX7ALDH1A1ESR1POLB
SCHEMBL930560 0.77 GRM5 (0.46) GRM5P2RX7ALDH1A1ESR1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2085398-A1 Pyrazolopyrimidines, a process for their preparation and their use as medicine Merz Pharma GmbH & Co. KGaA (DE) 2009-08-05 EP claimed
US-20110003820-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2011-01-06 US disclosed
EP-2247590-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE Merz Pharma GmbH & Co. KGaA (DE) 2010-11-10 EP disclosed
WO-2009095254-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE MERZ PHARMA GMBH & CO. KGAA (DE) 2009-08-06 WO disclosed
EP-2085398-A1 Pyrazolopyrimidines, a process for their preparation and their use as medicine Merz Pharma GmbH & Co. KGaA (DE) 2009-08-05 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-20110003820-A1 PYRAZOLOPYRIMIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINE GRM5, GRIK5, GRK5 GRM5 1/4885P2RX7 71/4885ALDH1A1 2888/4885

“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.