SCHEMBL9075282

SCHEMBL9075282

O=C(Oc1ccccc1)N1CCC(=C2c3ccccc3CCc3cccnc32)CC1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 5/20 0.73
PTAFR P25105 9/20 0.70
FNTA P49354 4/20 0.66
FNTB P49356 4/20 0.66
CHRM2 P08172 2/20 0.61
HTR2A P28223 2/20 0.61
OPRK1 P41145 2/20 0.61
HTR2B P41595 2/20 0.61
KCNH2 Q12809 2/20 0.61
HTR1A P08908 1/20 0.61
CHRM1 P11229 1/20 0.61
DRD2 P14416 1/20 0.61
HTR2C P28335 1/20 0.61
ADRA1A P35348 1/20 0.61
SLC6A15 Q9H2J7 7/20 0.59
MEN1 O00255 1/20 0.57
NPC1 O15118 1/20 0.57
CACNA1F O60840 1/20 0.57
NR1I2 O75469 1/20 0.57
GMNN O75496 1/20 0.57

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
SCHEMBL30056292 0.86 HRH1 (0.80) HRH1PTAFRFNTAFNTBCHRM2
SCHEMBL9073792 0.86 HRH1 (0.80) HRH1PTAFRFNTAFNTBCHRM2
SCHEMBL30055185 0.84 HRH1 (1.00) HRH1PTAFRFNTAFNTBCHRM2
SCHEMBL9075423 0.84 HRH1 (1.00) HRH1PTAFRFNTAFNTBCHRM2
SCHEMBL9073587 0.83 HRH1 (0.75) HRH1PTAFRFNTAFNTBCHRM2
SCHEMBL9073638 0.83 SLC6A15 (0.78) HRH1PTAFRFNTAFNTBCHRM2
SCHEMBL8879303 0.83 PTAFR (0.74) HRH1PTAFRFNTAFNTBCHRM2
SCHEMBL8877892 0.82 PTAFR (1.00) HRH1PTAFRFNTAFNTBCHRM2
SCHEMBL8889945 0.79 SLC6A15 (0.78) HRH1PTAFRFNTAFNTBCHRM2
SCHEMBL9374596 0.78 PTAFR (0.91) HRH1PTAFRFNTAFNTBCHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0563134-B1 AGENTS FOR POTENTIATING THE EFFECTS OF ANTITUMOR AGENTS AND COMBATING MULTIPLE DRUG RESISTANCE WELLCOME FOUND (GB) 1996-06-19 EP claimed
US-5416091-A Agents for potentiating the effects of antitumor agents and combating multiple drug resistance BURROUGHS WELLCOME CO. (US) 1995-05-16 US claimed
EP-0042544-B1 NOVEL ANTIHISTAMINES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORPORATION (US) 1984-10-03 EP claimed
EP-0042544-A2 Novel antihistamines, process for their preparation and pharmaceutical compositions containing them SCHERING CORPORATION (US) 1981-12-30 EP claimed
US-4282233-A NO SEDATIVE EFFECT SCHERING CORPORATION (US) 1981-08-04 US claimed
US-5416091-A Agents for potentiating the effects of antitumor agents and combating multiple drug resistance BURROUGHS WELLCOME CO. (US) 1995-05-16 US disclosed
US-4831042-A Tricyclic-substituted piperidine antihistamines SCHERING CORPORATION (US) 1989-05-16 US disclosed
US-4560688-A NON-SEDATING; CARBAMOYL OR SULFONAMIDE DERIVATIVES SCHERING CORPORATION (US) 1985-12-24 US disclosed
EP-0042544-B1 NOVEL ANTIHISTAMINES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORPORATION (US) 1984-10-03 EP disclosed
US-4454143-A Tricyclic antihistamines SCHERING CORPORATION (US) 1984-06-12 US disclosed
US-4355036-A Tricyclic-substituted piperidine antihistamines SCHERING CORPORATION (US) 1982-10-19 US disclosed
EP-0042544-A2 Novel antihistamines, process for their preparation and pharmaceutical compositions containing them SCHERING CORPORATION (US) 1981-12-30 EP disclosed
US-4282233-A NO SEDATIVE EFFECT SCHERING CORPORATION (US) 1981-08-04 US disclosed