Pyrazole

Pyrazole

SCHEMBL5064075

O=C(O)O.O=C(O)O.c1cn[nH]c1

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Pyrazole. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 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
Pyrazole SCHEMBL20495491 1.00
Oxalic Acid SCHEMBL27705066 0.92 HCAR2 (0.30) HCAR2
Oxalic Acid SCHEMBL27899728 0.92 HCAR2 (0.30) HCAR2
Pyrazole SCHEMBL27812310 0.90
Pyrazole SCHEMBL1768971 0.90
Pyrazole SCHEMBL4114829 0.90
Pyrazole SCHEMBL440249 0.90
Benzene SCHEMBL27522565 0.88
Benzene SCHEMBL27971048 0.88
Pyrazole SCHEMBL28050126 0.87 FFAR3 (0.33)

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
EP-2798013-A1 ANTI-REFLECTIVE COATING Leibniz-Institut für Neue Materialien gemeinnützige GmbH (DE) 2014-11-05 EP disclosed
WO-2013098090-A1 ANTI-REFLECTIVE COATING LEIBNIZ-INSTITUT FÜR NEUE MATERIALIEN GEMEINNÜTZIGE GMBH (DE) 2013-07-04 WO disclosed
EP-2001825-A1 METHOD FOR COMMERCIALLY OBTAINING PROPENE BASF SE (DE) 2008-12-17 EP disclosed
WO-2007113118-A1 METHOD FOR COMMERCIALLY OBTAINING PROPENE BASF SE (DE) 2007-10-11 WO disclosed