SCHEMBL2203441

SCHEMBL2203441

CC1CN(c2ncccc2Cl)CCN1C(=O)C1=NOC2(CCC(C(C)(C)C)CC2)C1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 3/20 0.46
TRPV1 Q8NER1 8/20 0.41
SLC6A7 Q99884 2/20 0.39
TRPA1 O75762 2/20 0.38
RBP4 P02753 1/20 0.38
CHRM4 P08173 1/20 0.37
SMO Q99835 2/20 0.37
AVPR1A P37288 1/20 0.36

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
SCHEMBL2203446 1.00 GRM1 (0.46) GRM1TRPV1SLC6A7TRPA1RBP4
SCHEMBL2209388 0.89 HSD11B1 (0.44) GRM1TRPV1SLC6A7TRPA1
SCHEMBL2209392 0.89 HSD11B1 (0.44) GRM1TRPV1SLC6A7TRPA1
SCHEMBL12512458 0.88 TRPV1 (0.41) GRM1TRPV1SLC6A7TRPA1RBP4
SCHEMBL2207492 0.87 TRPA1 (0.47) TRPV1TRPA1CHRM4
SCHEMBL2208267 0.87 TRPA1 (0.47) TRPV1TRPA1CHRM4
SCHEMBL2207487 0.87 TRPA1 (0.47) TRPV1TRPA1CHRM4
SCHEMBL5116605 0.86 TRPA1 (0.42) GRM1TRPV1SLC6A7TRPA1RBP4
SCHEMBL1457437 0.86 TRPV1 (0.39) GRM1TRPV1SLC6A7TRPA1RBP4
SCHEMBL2208046 0.84 CNR2 (0.47) TRPV1TRPA1CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7981883-B2 Substituted spiro-compounds and the use thereof for producing medicaments GRUENENTHAL GMBH (DE) 2011-07-19 US claimed
US-20090275628-A1 Substituted Spiro-Compounds And The Use Thereof For Producing Medicaments GRUENENTHAL GMBH (DE) 2009-11-05 US claimed
EP-1888542-A1 SUBSTITUTED SPIRO-COMPOUNDS AND THE USE THEREOF FOR PRODUCING MEDICAMENTS Grünenthal GmbH (DE) 2008-02-20 EP claimed
WO-2006136245-A1 SUBSTITUTED SPIRO-COMPOUNDS AND THE USE THEREOF FOR PRODUCING MEDICAMENTS Grünenthal GmbH (DE) 2006-12-28 WO claimed
US-7981883-B2 Substituted spiro-compounds and the use thereof for producing medicaments GRUENENTHAL GMBH (DE) 2011-07-19 US disclosed
US-20090275628-A1 Substituted Spiro-Compounds And The Use Thereof For Producing Medicaments GRUENENTHAL GMBH (DE) 2009-11-05 US disclosed
EP-1888542-A1 SUBSTITUTED SPIRO-COMPOUNDS AND THE USE THEREOF FOR PRODUCING MEDICAMENTS Grünenthal GmbH (DE) 2008-02-20 EP disclosed
WO-2006136245-A1 SUBSTITUTED SPIRO-COMPOUNDS AND THE USE THEREOF FOR PRODUCING MEDICAMENTS Grünenthal GmbH (DE) 2006-12-28 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-20090275628-A1 Substituted Spiro-Compounds And The Use Thereof For Producing Medicaments REN, PKD1, PKD2 GRM1 4246/4885TRPV1 649/4885SLC6A7 490/4885

“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.