SCHEMBL18880433

SCHEMBL18880433

CN(CCc1cnc[nH]1)Cc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 6/20 0.61
HRH3 Q9Y5N1 6/20 0.58
HRH4 Q9H3N8 5/20 0.52

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
SCHEMBL20194731 0.79 TAAR1 (0.58) TAAR1HRH3HRH4
SCHEMBL17383815 0.77 HRH3 (0.60) HRH3HRH4
SCHEMBL224745 0.77 TAAR1 (1.00) TAAR1HRH3HRH4
SCHEMBL1239352 0.75 HRH3 (0.76) HRH3HRH4
SCHEMBL8402960 0.74 SIGMAR1 (0.71) TAAR1
SCHEMBL2536900 0.74 HRH3 (0.93) TAAR1HRH3HRH4
SCHEMBL22894772 0.73 HRH3 (0.48) TAAR1HRH3HRH4
SCHEMBL5349780 0.73 CHRNA7 (0.67)
SCHEMBL631711 0.72 TAAR1 (1.00) TAAR1HRH3
SCHEMBL7055109 0.72 CARM1 (0.75) TAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3495365-A1 P2X7 MODULATORS Janssen Pharmaceutica NV (BE) 2019-06-12 EP disclosed
EP-3239151-A1 P2X7 MODULATORS Janssen Pharmaceutica NV (BE) 2017-11-01 EP disclosed
EP-2970267-B1 P2X7 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2017-05-24 EP disclosed