SCHEMBL701270

SCHEMBL701270

CC(C)(C)OC(=O)N1CCC(CCCO)(c2cccc(F)c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 1/20 0.49
CCR5 P51681 11/20 0.47
GPR119 Q8TDV5 1/20 0.45
ATM Q13315 1/20 0.43
KCNH2 Q12809 1/20 0.41
TSHR P16473 2/20 0.41
ALOX15 P16050 1/20 0.41
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41

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
SCHEMBL701407 0.89 TACR1 (0.53) TACR1CCR5GPR119ATMTSHR
SCHEMBL702431 0.88 CCR5 (0.55) TACR1CCR5GPR119ATMKCNH2
SCHEMBL702100 0.88 TACR1 (0.57) TACR1CCR5ATM
SCHEMBL702500 0.87 CCR5 (0.55) TACR1CCR5ATMTSHRALOX15
SCHEMBL701482 0.86 TACR1 (0.45) TACR1CCR5GPR119
SCHEMBL2469527 0.86 TACR1 (0.52) TACR1CCR5GPR119ATMTSHR
SCHEMBL4551945 0.85 TACR1 (0.53) TACR1CCR5GPR119ATMTSHR
SCHEMBL31693832 0.85 TACR1 (0.53) TACR1CCR5GPR119ATMTSHR
SCHEMBL703588 0.84 TACR1 (0.46) TACR1CCR5GPR119ATMKCNH2
SCHEMBL2470882 0.82 TACR1 (0.48) TACR1CCR5GPR119ATMTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124624-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-02-28 US disclosed
US-8124624-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-02-28 US disclosed
US-8124624-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-02-28 US disclosed
EP-2262791-A2 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2010-12-22 EP disclosed
US-20090264407-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-22 US disclosed
US-20090264407-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-22 US disclosed
US-20090264407-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-22 US disclosed
WO-2009124734-A2 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2009-10-15 WO disclosed
WO-2009124734-A2 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2009-10-15 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-20090264407-A1 Substituted Sulfonamide Compounds CNR1, SUCNR1, OPRL1 TACR1 18/4885CCR5 1218/4885GPR119 98/4885

“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.