SCHEMBL13007658

SCHEMBL13007658

CC(C)(C)N1CCC(CCN2CCCC2)CC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.44
CARM1 Q86X55 1/20 0.34
PRMT6 Q96LA8 1/20 0.34
PRMT8 Q9NR22 1/20 0.34
CHRM5 P08912 1/20 0.34
ADRA2C P18825 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
GNAO1 P09471 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.33
SIRT1 Q96EB6 1/20 0.33
SIRT3 Q9NTG7 1/20 0.33
SIGMAR1 Q99720 1/20 0.33

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
SCHEMBL13007653 0.98 CYP1A2 (0.47) CYP1A2CARM1PRMT6PRMT8CHRM5
SCHEMBL9611075 0.90 GNAO1 (0.34) CYP1A2CARM1PRMT6GNAO1
SCHEMBL13007655 0.89 CYP1A2 (0.43) CYP1A2CHRM5ADRA2CHRH3SIGMAR1
SCHEMBL13007656 0.86 NCF1 (0.38) CYP1A2HRH3GNAO1SIGMAR1
SCHEMBL24453221 0.85 GNAO1 (0.35) CYP1A2CARM1PRMT6GNAO1
SCHEMBL20317545 0.83 GNAO1 (0.31) CYP1A2GNAO1SIGMAR1
SCHEMBL26028074 0.83 GNAO1 (0.44) CHRM5GNAO1SIGMAR1
SCHEMBL17451649 0.83 CYP1A2 (0.42) CYP1A2SIGMAR1
SCHEMBL21933469 0.83 CYP1A2 (0.36) CYP1A2CARM1PRMT6GNAO1
SCHEMBL2629515 0.82 CHRM5 (0.56) CHRM5ADRA2CHRH3

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-8435978-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-05-07 US disclosed
US-20100324009-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2010-12-23 US disclosed
US-20100324009-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2010-12-23 US disclosed
US-20100317644-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2010-12-16 US disclosed
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS GRUENENTHAL GMBH (DE) 2008-06-26 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 (3 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-20100317644-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 CYP1A2 705/4885CARM1 4617/4885PRMT6 4399/4885
US-20100324009-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 CYP1A2 705/4885CARM1 4617/4885PRMT6 4399/4885
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS SULT2A1, STS, SULT1A1 CYP1A2 705/4885CARM1 4617/4885PRMT6 4399/4885

“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.