SCHEMBL6162512

SCHEMBL6162512

Fc1ccc(Cc2cccc(C3=CCNCC3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 8/20 0.54
SIGMAR1 Q99720 2/20 0.51
KHK P50053 2/20 0.47
QDPR P09417 2/20 0.44
HTR6 P50406 2/20 0.44
PTPN5 P54829 1/20 0.41

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
SCHEMBL11204336 0.89 SIGMAR1 (0.67) HTR2CSIGMAR1KHKQDPRHTR6
SCHEMBL3032622 0.87 HTR2C (0.54) HTR2CSIGMAR1KHKQDPRHTR6
SCHEMBL4789465 0.79 HTR2C (0.66) HTR2CSIGMAR1KHKQDPRHTR6
SCHEMBL28015195 0.79 HTR2C (0.60) HTR2CSIGMAR1KHKQDPRHTR6
Hydrochloric Acid SCHEMBL9532611 0.78 HTR2C (0.67) HTR2CSIGMAR1KHKQDPRHTR6
SCHEMBL532892 0.77 HTR2C (0.66) HTR2CSIGMAR1KHKQDPRHTR6
SCHEMBL6278676 0.76 HTR2C (0.57) HTR2CSIGMAR1KHKQDPRHTR6
Hydrochloric Acid SCHEMBL730625 0.76 HTR2C (0.67) HTR2CSIGMAR1KHKQDPRHTR6
SCHEMBL22144414 0.75 HTR2C (0.56) HTR2CSIGMAR1KHKQDPRHTR6
SCHEMBL6160755 0.74 HTR2C (0.47) HTR2CSIGMAR1HTR6

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-0755923-B1 Ameliorant or remedy for symptoms caused by Ischemic diseases and Phenylpiperidine compounds useful therefor DAIICHI SUNTORY PHARMA CO LTD (JP) 2005-05-04 EP disclosed
US-6469010-B1 COMPOSITION ALSO FOR ALLEVIATION OR TREATMENT OF SYMPTOMS DERIVED FROM SEIZURES, EPILEPSY AND MIGRAINE HEADACHES, AND SUPPRESSION OF CALCIUM ION OVERLOAD SUNTORY LIMITED (JP) 2002-10-22 US disclosed
US-6048876-A ANTICONVULSANTS; ANTIEPILEPIC AGENT SUNTORY LIMITED (JP) 2000-04-11 US disclosed
EP-0755923-A1 AMELIORANT OR REMEDY FOR SYMPTOMS CAUSED BY ISCHEMIC DISEASES AND COMPOUNDS USEFUL THEREFOR SUNTORY LIMITED (JP) 1997-01-29 EP disclosed