SCHEMBL30120903

SCHEMBL30120903

Cc1nn(-c2ccnc(Cc3cc(F)cc(C(F)(F)F)c3)c2)cc1C(=O)N(C)C

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 18/20 0.55
ALDH1A1 P00352 1/20 0.36
TACR1 P25103 1/20 0.36

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
SCHEMBL23803789 1.00 GPR52 (0.55) GPR52ALDH1A1TACR1
SCHEMBL23803849 0.90 GPR52 (0.57) GPR52
SCHEMBL30120969 0.90 GPR52 (0.57) GPR52
SCHEMBL30152179 0.89 GPR52 (0.56) GPR52
SCHEMBL23803837 0.89 GPR52 (0.56) GPR52
SCHEMBL23803890 0.88 GPR52 (0.56) GPR52
SCHEMBL30120850 0.88 GPR52 (0.56) GPR52
SCHEMBL23803883 0.87 GPR52 (0.55) GPR52
SCHEMBL30120942 0.87 GPR52 (0.55) GPR52
SCHEMBL23803891 0.86 GPR52 (0.54) GPR52ALDH1A1

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-4117784-B1 GPR52 MODULATOR COMPOUNDS NXERA PHARMA UK LTD (GB) 2024-08-28 EP claimed
EP-4117784-A1 GPR52 MODULATOR COMPOUNDS Heptares Therapeutics Limited (GB) 2023-01-18 EP claimed
EP-4117784-B1 GPR52 MODULATOR COMPOUNDS NXERA PHARMA UK LTD (GB) 2024-08-28 EP disclosed
EP-4117784-A1 GPR52 MODULATOR COMPOUNDS Heptares Therapeutics Limited (GB) 2023-01-18 EP disclosed