SCHEMBL24288237

SCHEMBL24288237

Cc1ccc(-c2cnc(NCC3CCCN(C)C3)nc2C)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PRKCQ Q04759 9/20 0.48
▸ HRH4 Q9H3N8 6/20 0.40
▸ HCRTR1 O43613 3/20 0.38
▸ SCN9A Q15858 1/20 0.37
▸ HCRTR2 O43614 1/20 0.37

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
SCHEMBL24288241 0.89 PRKCQ (0.39) PRKCQHRH4HCRTR1HCRTR2
SCHEMBL24288100 0.88 PRKCQ (0.47) PRKCQHRH4SCN9A
Hydrochloric Acid SCHEMBL30838083 0.88 PRKCQ (0.49) PRKCQHRH4
SCHEMBL24288090 0.86 HRH4 (0.45) PRKCQHRH4
Hydrochloric Acid SCHEMBL30838015 0.85 HRH4 (0.45) PRKCQHRH4
Formic Acid SCHEMBL30838073 0.84 PRKCQ (0.41) PRKCQHRH4
SCHEMBL27095173 0.83 PRKCQ (0.50) PRKCQHRH4
Hydrochloric Acid SCHEMBL30838056 0.82 PRKCQ (0.49) PRKCQHRH4
Formic Acid SCHEMBL30838087 0.78 HRH4 (0.41) HRH4
Hydrochloric Acid SCHEMBL30838055 0.77 PRKCQ (0.40) PRKCQ

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
WO-2022053823-A1 SUBSTITUTED PYRIMIDINE DERIVATIVES AS NICOTINIC ACETYLCHOLINESTERASE RECEPTOR ALPHA 6 MODULATOR Cerevance, Inc. (US) 2022-03-17 — — WO disclosed
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