SCHEMBL4131722

SCHEMBL4131722

CNCCC1CCC(CCc2ccccc2)(N(C)C)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 2/20 0.48
PRMT6 Q96LA8 2/20 0.48
ATM Q13315 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
OPRM1 P35372 4/20 0.40
OPRL1 P41146 4/20 0.40
SIGMAR1 Q99720 1/20 0.40
CHRM2 P08172 5/20 0.39
CHRM1 P11229 5/20 0.39
CHRM3 P20309 5/20 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
SCHEMBL4123322 0.86 OPRM1 (0.49) CARM1PRMT6ATMTAAR1OPRM1
SCHEMBL4130314 0.77 CARM1 (0.50) CARM1PRMT6ATMTAAR1L3MBTL1
SCHEMBL4046260 0.77 OPRL1 (0.50) TAAR1OPRM1OPRL1CHRM2CHRM1
SCHEMBL4118199 0.74 OPRL1 (0.55) OPRM1OPRL1
Hydrochloric Acid SCHEMBL2877571 0.73 OPRL1 (0.56) OPRM1OPRL1
SCHEMBL4046256 0.71 ALDH1A1 (0.44) MEN1KMT2AOPRM1OPRL1
SCHEMBL4118117 0.70 OPRM1 (0.45) TAAR1MEN1KMT2AOPRM1OPRL1
SCHEMBL15681095 0.70 SIGMAR1 (0.47) OPRM1OPRL1SIGMAR1
SCHEMBL4132070 0.70 CARM1 (0.48) CARM1PRMT6ATMTAAR1L3MBTL1
SCHEMBL1303916 0.69 OPRM1 (0.44) TAAR1L3MBTL1MEN1KMT2AOPRM1

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-20090253669-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-08 US disclosed
US-20090253669-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-08 US disclosed
US-20090253669-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-08 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-20090253669-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 CARM1 4222/4885PRMT6 3888/4885ATM 2938/4885

“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.