SCHEMBL9843626

SCHEMBL9843626

Oc1ccc(C2CC=NN2c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PRKCZ Q05513 5/20 0.54
▸ MEN1 O00255 3/20 0.50
▸ KMT2A Q03164 3/20 0.50
▸ HSP90AA1 P07900 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ RIPK1 Q13546 11/20 0.44
▸ ATM Q13315 1/20 0.42
▸ ALDH1A1 P00352 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
SCHEMBL11066334 0.88 RIPK1 (0.50) MEN1KMT2AHSP90AA1RIPK1ATM
SCHEMBL3679184 0.77 SMN1; SMN2 (0.52) PRKCZMEN1KMT2ARIPK1ATM
SCHEMBL22691826 0.72 RIPK1 (0.46) MEN1KMT2ARIPK1ATMALDH1A1
SCHEMBL8373384 0.72 PRKCZ (0.82) PRKCZMEN1KMT2AHSP90AA1GAA
SCHEMBL25370685 0.72 MAPT (0.62) MEN1KMT2AHSP90AA1GAARIPK1
SCHEMBL6225415 0.72 CA1 (0.61) GAAATMALDH1A1
SCHEMBL5693255 0.72 PTGS2 (0.55) MEN1KMT2AGAARIPK1ATM
SCHEMBL23962450 0.70 MEN1 (0.82) PRKCZMEN1KMT2AHSP90AA1GAA
SCHEMBL8179557 0.69 MEN1 (0.82) PRKCZMEN1KMT2AHSP90AA1GAA
SCHEMBL5903097 0.68 CA12 (0.41) PRKCZMEN1KMT2AGAARIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0409026-A1 Fungicidal agent based on 1,3,5-triaryl-2-pyrazolin derivatives new 1,3,5-triaryl-2-pyrazolins and process for their preparation BAYER AG (DE) 1991-01-23 — — EP disclosed
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