SCHEMBL6401322

SCHEMBL6401322

O=C(OCc1ccccc1)C1CCc2ccccc2N1C(=O)CCN1CCC2(CCc3ccccc32)CC1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 12/20 0.49
SIGMAR1 Q99720 6/20 0.48
OPRK1 P41145 4/20 0.47
OPRM1 P35372 1/20 0.46
ALDH1A1 P00352 1/20 0.45
TP53 P04637 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
TSHR P16473 1/20 0.45
CYP2C19 P33261 1/20 0.45
SLC18A3 Q16572 1/20 0.43

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
SCHEMBL6395194 0.81 OPRL1 (0.54) OPRL1SIGMAR1OPRM1SLC18A3
SCHEMBL6394179 0.81 OPRL1 (0.54) OPRL1SIGMAR1OPRM1SLC18A3
Hydrochloric Acid SCHEMBL7070297 0.80 OPRL1 (0.53) OPRL1SIGMAR1OPRM1SLC18A3
SCHEMBL6396533 0.79 DRD2 (0.50) OPRL1SIGMAR1OPRM1SLC18A3
SCHEMBL6396536 0.79 DRD2 (0.50) OPRL1SIGMAR1OPRM1SLC18A3
Citric Acid SCHEMBL6394947 0.79 OPRL1 (0.45) OPRL1SIGMAR1OPRK1OPRM1SLC18A3
Hydrochloric Acid SCHEMBL6395171 0.79 DRD2 (0.49) OPRL1SIGMAR1OPRM1SLC18A3
Hydrochloric Acid SCHEMBL6395143 0.79 DRD2 (0.49) OPRL1SIGMAR1OPRM1SLC18A3
SCHEMBL6394941 0.78 OPRL1 (0.50) OPRL1SIGMAR1OPRM1SLC18A3
SCHEMBL6395355 0.78 OPRL1 (0.50) OPRL1SIGMAR1OPRM1SLC18A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2057222-B2 COMPOSITION COMPRISING LIQUID PHOSPHITE BLENDS AS STABILIZERS ADDIVANT SWITZERLAND GMBH (CH) 2017-03-01 EP disclosed
US-6919389-B2 Polymer compositions containing benzimidazole based stabilizer compounds CROMPTON CORPORATION (US) 2005-07-19 US disclosed
US-20050038060-A1 Spiropoperidine compounds as ligands for orl-1 receptor ANDO KOJI (JP) 2005-02-17 US disclosed
US-20040180995-A1 Polymer compositions containing benzimidazole based stabilizer compounds ADDIVANT USA, LLC 2004-09-16 US disclosed
EP-1399432-A1 SPIROPIPERIDINE COMPOUNDS AS LIGANDS FOR ORL-1 RECEPTOR PFIZER INC. (US) 2004-03-24 EP disclosed
WO-2003000677-A1 SPIROPIPERIDINE COMPOUNDS AS LIGANDS FOR ORL-1 RECEPTOR PFIZER PHARMACEUTICALS INC. (JP) 2003-01-03 WO disclosed
US-6214915-B1 AROMATIC KETONE STABILIZER GENERAL ELECTRIC COMPANY 2001-04-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050038060-A1 Spiropoperidine compounds as ligands for orl-1 receptor OPRL1, OXER1, OGFRL1 OPRL1 1/4885SIGMAR1 11/4885OPRK1 13/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.