SCHEMBL6159816

SCHEMBL6159816

COc1ccc(CN2CCN(c3ccc(-c4ccc(F)cc4)cc3C)CC2)c(OC)c1OC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
KDM4E B2RXH2 7/20 0.61
HTT P42858 3/20 0.57
CHRM2 P08172 2/20 0.57
OPRK1 P41145 2/20 0.57
DRD2 P14416 2/20 0.57
DRD3 P35462 2/20 0.57
ADORA3 P0DMS8 1/20 0.57
CHRM1 P11229 1/20 0.57
ADRA2B P18089 1/20 0.57
ADRA2C P18825 1/20 0.57
CNR1 P21554 1/20 0.57
SLC6A2 P23975 1/20 0.57
HTR2A P28223 1/20 0.57
HTR2C P28335 1/20 0.57
ADRA1A P35348 1/20 0.57
HRH1 P35367 1/20 0.57
OPRM1 P35372 1/20 0.57
HTR2B P41595 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
Hydrochloric Acid SCHEMBL7328045 0.86 LMNA (0.64) LMNASMN1; SMN2KDM4EHTTCHRM2
Hydrochloric Acid SCHEMBL7328249 0.80 APOBEC3A (0.57) LMNASMN1; SMN2KDM4EHTTCHRM2
SCHEMBL8989176 0.78 CHRM2 (0.55) LMNASMN1; SMN2KDM4EHTTCHRM2
SCHEMBL4754210 0.77 KDM4E (1.00) LMNASMN1; SMN2KDM4EHTTCHRM2
Hydrochloric Acid SCHEMBL7333899 0.77 APOBEC3A (0.56) LMNASMN1; SMN2KDM4EHTTCHRM2
SCHEMBL7334983 0.77 MEN1 (0.60) LMNASMN1; SMN2KDM4EHTTCHRM2
SCHEMBL28298203 0.76 CHRM2 (0.79) LMNASMN1; SMN2KDM4EHTTCHRM2
Hydrochloric Acid SCHEMBL7326029 0.76 MEN1 (0.58) LMNASMN1; SMN2KDM4EHTTCHRM2
SCHEMBL6159814 0.76 LMNA (0.88) LMNASMN1; SMN2KDM4EHTTCHRM2
Hydrochloric Acid SCHEMBL8989118 0.76 ALDH1A1 (0.63) LMNASMN1; SMN2KDM4EHTTCHRM2

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 2 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