SCHEMBL9380680

SCHEMBL9380680

Cc1nc2cnccc2n1-c1ccc(C(=O)N2CCC(=C3c4ccccc4CCc4cccnc43)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTAFR P25105 10/20 0.55
▸ HRH1 P35367 4/20 0.53
▸ FNTA P49354 5/20 0.51
▸ FNTB P49356 5/20 0.51
▸ CHRM2 P08172 2/20 0.48
▸ HTR2A P28223 2/20 0.48
▸ OPRK1 P41145 2/20 0.48
▸ HTR2B P41595 2/20 0.48
▸ KCNH2 Q12809 2/20 0.48
▸ HTR1A P08908 1/20 0.48
▸ CHRM1 P11229 1/20 0.48
▸ DRD2 P14416 1/20 0.48
▸ HTR2C P28335 1/20 0.48
▸ ADRA1A P35348 1/20 0.48
▸ SLC6A15 Q9H2J7 3/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ CACNA1F O60840 1/20 0.43
▸ NR1I2 O75469 1/20 0.43
▸ GMNN O75496 1/20 0.43

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
SCHEMBL9333178 0.93 FNTA (0.46) PTAFRHRH1FNTAFNTB
SCHEMBL9333282 0.92 PTAFR (0.59) PTAFRHRH1FNTAFNTBCHRM2
SCHEMBL9332876 0.91 FNTA (0.65) PTAFRHRH1FNTAFNTBCHRM2
SCHEMBL9333210 0.84 FNTA (0.52) PTAFRHRH1FNTAFNTBCHRM2
SCHEMBL9332766 0.84 FNTA (0.52) PTAFRHRH1FNTAFNTBCHRM2
SCHEMBL9332755 0.83 FNTA (0.63) PTAFRHRH1FNTAFNTBCHRM2
SCHEMBL9332709 0.81 FNTA (0.63) PTAFRHRH1FNTAFNTBCHRM2
SCHEMBL9705980 0.81 FNTA (0.48) PTAFRHRH1FNTAFNTBCHRM2
SCHEMBL9332847 0.80 DRD3 (0.51) HRH1CHRM2HTR2AOPRK1HTR2B
SCHEMBL9333208 0.80 HRH1 (0.44) HRH1FNTAFNTB

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-0572425-B1 IMIDAZOPYRIDINE PAF/H 1 ANTAGONISTS PFIZER LTD (GB) 1994-08-03 — — EP disclosed
Send feedback