SCHEMBL8558759

SCHEMBL8558759

C=CC[C@H]1CCCC[C@]1(c1cccs1)N1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRCP P42785 2/20 0.49
SIGMAR1 Q99720 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
SLC6A2 P23975 3/20 0.38
SLC6A9 P48067 2/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 1/20 0.38
OPRM1 P35372 1/20 0.36
OPRL1 P41146 1/20 0.36
CHRM3 P20309 2/20 0.35
SLC6A3 Q01959 1/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
SLC6A4 P31645 3/20 0.33
CYP2D6 P10635 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CHRM1 P11229 1/20 0.33

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
SCHEMBL8205125 1.00 PRCP (0.49) PRCPSIGMAR1MEN1KMT2ASLC6A2
SCHEMBL8205657 0.79 PRCP (0.37) PRCPSIGMAR1SLC6A2SLC6A9GAA
Gacyclidine SCHEMBL397836 0.78 SIGMAR1 (0.57) PRCPSIGMAR1MEN1KMT2ASLC6A2
Gacyclidine SCHEMBL3457748 0.78 SIGMAR1 (0.57) PRCPSIGMAR1MEN1KMT2ASLC6A2
Gacyclidine SCHEMBL7190367 0.78 SIGMAR1 (0.57) PRCPSIGMAR1MEN1KMT2ASLC6A2
Gacyclidine SCHEMBL4465879 0.78 SIGMAR1 (0.57) PRCPSIGMAR1MEN1KMT2ASLC6A2
Gacyclidine SCHEMBL5398234 0.77 SIGMAR1 (0.56) PRCPSIGMAR1MEN1KMT2ASLC6A2
Gacyclidine SCHEMBL1662223 0.77 SIGMAR1 (0.56) PRCPSIGMAR1MEN1KMT2ASLC6A2
SCHEMBL8520711 0.76 PRCP (0.40) PRCPSIGMAR1GAAMAPTHPGD
SCHEMBL8560436 0.76 PRCP (0.40) PRCPSIGMAR1GAAMAPTHPGD

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-5972952-A THERAPY FOR STROKE, NERVOUS SYSTEM DISORDERS, ALZHEIMER'SDISEASE LE CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1999-10-26 US claimed
US-5972952-A THERAPY FOR STROKE, NERVOUS SYSTEM DISORDERS, ALZHEIMER'SDISEASE LE CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1999-10-26 US disclosed
US-5972952-A THERAPY FOR STROKE, NERVOUS SYSTEM DISORDERS, ALZHEIMER'SDISEASE LE CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 1999-10-26 US disclosed