SCHEMBL9332847

SCHEMBL9332847

Cc1nc2cnccc2n1-c1ccc(C(=O)N2CCC(=C3c4ccccc4CC(=O)c4sccc43)CC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD3 P35462 4/20 0.51
▸ HRH1 P35367 3/20 0.51
▸ LMNA P02545 2/20 0.51
▸ CHRM2 P08172 2/20 0.51
▸ CHRM4 P08173 2/20 0.51
▸ CHRM5 P08912 2/20 0.51
▸ ADRA2A P08913 2/20 0.51
▸ CHRM1 P11229 2/20 0.51
▸ ADRA2B P18089 2/20 0.51
▸ CHRM3 P20309 2/20 0.51
▸ DRD1 P21728 2/20 0.51
▸ HTR2A P28223 2/20 0.51
▸ HTR2C P28335 2/20 0.51
▸ HTR3A P46098 2/20 0.51
▸ HTR6 P50406 2/20 0.51
▸ HRH4 Q9H3N8 2/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ TSHR P16473 1/20 0.51

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 0.87 FNTA (0.46) HRH1ALDH1A1HPGDHRH3ROCK2
SCHEMBL9333208 0.85 HRH1 (0.44) HRH1HRH4ALDH1A1HPGDHRH3
SCHEMBL9380680 0.80 PTAFR (0.55) HRH1LMNACHRM2CHRM1CHRM3
SCHEMBL14475368 0.78 DRD3 (0.61) DRD3HRH1LMNACHRM2CHRM4
SCHEMBL30471280 0.78 DRD3 (0.61) DRD3HRH1LMNACHRM2CHRM4
SCHEMBL9333210 0.77 FNTA (0.52) HRH1LMNACHRM2CHRM3HTR2A
SCHEMBL9332766 0.76 FNTA (0.52) HRH1LMNACHRM2CHRM3HTR2A
SCHEMBL9333282 0.75 PTAFR (0.59) HRH1LMNACHRM2CHRM3HTR2A
SCHEMBL9332876 0.73 FNTA (0.65) HRH1LMNACHRM2CHRM3HTR2A
SCHEMBL9039987 0.73 DRD3 (0.77) DRD3HRH1LMNACHRM2CHRM4

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
US-5358953-A For treatment of allergic rhinitis PFIZER INC. (US) 1994-10-25 — — US disclosed
EP-0572425-B1 IMIDAZOPYRIDINE PAF/H 1 ANTAGONISTS PFIZER LTD (GB) 1994-08-03 — — EP disclosed
WO-1992014734-A1 IMIDAZOPYRIDINE PAF/H1 ANTAGONISTS PFIZER LIMITED (GB) 1992-09-03 — — WO disclosed
Send feedback