SCHEMBL6966857

SCHEMBL6966857

COC(=O)C1(c2ccccc2)CCNCC1CCCN

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.41
OPRM1 P35372 1/20 0.40
HTR2C P28335 1/20 0.40
TMEM97 Q5BJF2 1/20 0.39
ARG1 P05089 2/20 0.39
ARG2 P78540 2/20 0.39

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
SCHEMBL9396813 0.85 SLC6A2 (0.40) HTR2CARG1ARG2
SCHEMBL7244779 0.77 SLC6A4 (0.42) OPRM1ARG1ARG2
SCHEMBL6847573 0.75 OPRM1 (0.37) OPRM1ARG1ARG2
SCHEMBL7211919 0.75 OPRM1 (0.43) SIGMAR1OPRM1HTR2C
SCHEMBL7216822 0.75 OPRM1 (0.39) OPRM1HTR2CARG1ARG2
SCHEMBL7237713 0.74 KIF11 (0.40) OPRM1
SCHEMBL7245785 0.73 ARG1 (0.36) OPRM1ARG1ARG2
SCHEMBL11118224 0.68 OPRM1 (0.42) OPRM1
SCHEMBL21119266 0.68 OPRM1 (0.42) OPRM1
SCHEMBL11094114 0.68 OPRM1 (0.60) OPRM1

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