SCHEMBL6969152

SCHEMBL6969152

SCOc1ccc(C2(c3ccccc3)CCNCC2)cc1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 5/20 0.62
AKT2 P31751 2/20 0.50
HTR2A P28223 1/20 0.50
TACR1 P25103 5/20 0.40
AKT1 P31749 1/20 0.37
AKT3 Q9Y243 1/20 0.37
PSMB1 P20618 1/20 0.36
PSMB5 P28074 1/20 0.36
PSMB2 P49721 1/20 0.36
MEN1 O00255 1/20 0.36
CYP2C9 P11712 1/20 0.36
KMT2A Q03164 1/20 0.36
LTA4H P09960 1/20 0.35
OPRL1 P41146 1/20 0.34

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 SCHEMBL6198471 0.98 OPRM1 (0.61) OPRM1AKT2HTR2ATACR1AKT1
Hydrochloric Acid SCHEMBL2523744 0.80 OPRM1 (0.56) OPRM1AKT2HTR2ATACR1
SCHEMBL738518 0.79 OPRM1 (1.00) OPRM1AKT2HTR2ATACR1AKT1
SCHEMBL6198602 0.79 OPRM1 (0.69) OPRM1AKT2HTR2ATACR1LTA4H
Hydrochloric Acid SCHEMBL1765284 0.77 OPRM1 (0.95) OPRM1AKT2HTR2ATACR1MEN1
SCHEMBL6969149 0.75 OPRM1 (0.62) OPRM1AKT2HTR2ATACR1AKT1
Hydrochloric Acid SCHEMBL6198470 0.74 OPRM1 (0.61) OPRM1AKT2HTR2ATACR1AKT1
SCHEMBL1977652 0.73 OPRM1 (0.77) OPRM1AKT2HTR2ATACR1AKT1
SCHEMBL1257446 0.73 OPRM1 (0.77) OPRM1AKT2HTR2ATACR1AKT1
SCHEMBL7885473 0.72 OPRM1 (0.83) OPRM1AKT2HTR2ATACR1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6620815-B1 Selective antagonists for human alpha 1A receptors; benign prostatic hyperplasia, impotency, cardiac arrhythmia treatment; anticholesterol agents; intraocular pressure reduction SYNAPTIC PHARMACEUTICAL CORPORATION 2003-09-16 US disclosed
EP-0988295-A4 HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF SYNAPTIC PHARMA CORP (US) 2003-08-13 EP disclosed
US-6159990-A Oxazolidinones as α1A receptor antagonists SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-12-12 US disclosed
EP-0988295-A1 HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 2000-03-29 EP disclosed
WO-1998057940-A1 HETEROCYCLIC SUBSTITUTED PIPERIDINES AND USES THEREOF SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1998-12-23 WO disclosed