SCHEMBL13429308

SCHEMBL13429308

Clc1cc(Cl)cc(O[C@H]2CN3CCC2CC3)c1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LSS P48449 1/20 0.57
GLA P06280 1/20 0.47
TSHR P16473 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
MAPT P10636 1/20 0.44
CHRNA7 P36544 1/20 0.44

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
SCHEMBL3215242 0.84 TSHR (0.56) LSSGLATSHRRXFP1MAPT
SCHEMBL3215247 0.84 TSHR (0.56) LSSGLATSHRRXFP1MAPT
Hydrochloric Acid SCHEMBL9469012 0.83 TSHR (0.59) LSSGLATSHRRXFP1MAPT
SCHEMBL3215152 0.83 LSS (0.78) LSSGLATSHRRXFP1NPC1
SCHEMBL3215158 0.83 LSS (0.78) LSSGLATSHRRXFP1NPC1
Hydrochloric Acid SCHEMBL9469303 0.81 LSS (0.76) LSSGLATSHRRXFP1NPC1
SCHEMBL13429323 0.79 LSS (0.57) LSSGLACHRNA7
SCHEMBL9469306 0.79 LSS (0.57) LSSGLACHRNA7
SCHEMBL13429315 0.79 LSS (0.56) LSSGLATSHRRXFP1NPC1
SCHEMBL3221930 0.76 LSS (0.54) LSSGLACHRNA7

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-20100056565-A1 Heterocyclic Derivatives as M3 Muscarinic Receptors ARGENTA DISCOVERY LIMITED (GB) 2010-03-04 US disclosed
US-20100056565-A1 Heterocyclic Derivatives as M3 Muscarinic Receptors ARGENTA DISCOVERY LIMITED (GB) 2010-03-04 US disclosed
WO-2008099186-A1 HETEROCYCLIC DERIVATIVES AS M3 MUSCARINIC RECEPTORS ARGENTA DISCOVERY LIMITED (GB) 2008-08-21 WO 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-20100056565-A1 Heterocyclic Derivatives as M3 Muscarinic Receptors CHRM2, CHRM3, CHRM1 LSS 4700/4885GLA 3206/4885TSHR 19/4885

“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.