SCHEMBL6035012

SCHEMBL6035012

COc1ccccc1CCN(C)CCCCC(=O)c1ccc2c(c1)CN(C)C(=O)N2C

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.44
BCHE P06276 4/20 0.42
ACHE P22303 4/20 0.42
CHRM2 P08172 2/20 0.42
CHRM1 P11229 1/20 0.42
DRD4 P21917 2/20 0.41
DRD2 P14416 1/20 0.39
MAOB P27338 3/20 0.39
MAOA P21397 1/20 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
Hydrochloric Acid SCHEMBL4861132 0.99 SIGMAR1 (0.43) SIGMAR1BCHEACHECHRM2CHRM1
SCHEMBL13988069 0.88 KMT2A (0.38) SIGMAR1BCHEACHEDRD2
SCHEMBL6035468 0.88 SIGMAR1 (0.44) SIGMAR1BCHEACHECHRM2CHRM1
SCHEMBL6035073 0.87 MCHR1 (0.38) BCHEACHECHRM1DRD2
Hydrochloric Acid SCHEMBL4861295 0.87 SIGMAR1 (0.43) SIGMAR1BCHEACHECHRM2CHRM1
Hydrochloric Acid SCHEMBL4857673 0.86 MCHR1 (0.38) BCHEACHECHRM1DRD2
SCHEMBL6034199 0.85 THRA (0.46) SIGMAR1ACHE
SCHEMBL13987735 0.84 SIGMAR1 (0.42) SIGMAR1BCHEACHECHRM2CHRM1
Hydrochloric Acid SCHEMBL4853622 0.84 THRA (0.45) SIGMAR1ACHE
Hydrochloric Acid SCHEMBL5984191 0.83 SIGMAR1 (0.42) SIGMAR1BCHEACHECHRM2CHRM1

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-20060063769-A1 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-03-23 US claimed
US-7462628-B2 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-09 US disclosed
US-7462628-B2 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-12-09 US disclosed
US-7132547-B2 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-11-07 US disclosed
US-20060063769-A1 Preventives/remedies for urinary disturbance TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-03-23 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-20060063769-A1 Preventives/remedies for urinary disturbance ACHE, BPHL, CHRM1 SIGMAR1 2780/4885BCHE 23/4885ACHE 1/4885

“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.