SCHEMBL4009984

SCHEMBL4009984

O=C(N[C@@H]1CCCCNC1=O)C1CCCCO1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 12/20 0.62
RAB9A P51151 2/20 0.51
NPC1 O15118 1/20 0.48
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.46

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
SCHEMBL3319001 0.77 CCR2 (1.00) CCR2RAB9ANPC1ALDH1A1KDM4E
SCHEMBL13006179 0.77 CCR2 (1.00) CCR2RAB9ANPC1ALDH1A1KDM4E
SCHEMBL319610 0.75 CCR2 (0.68) CCR2RAB9ANPC1ALDH1A1KDM4E
SCHEMBL3487757 0.75 CCR2 (0.68) CCR2RAB9ANPC1ALDH1A1KDM4E
SCHEMBL3241217 0.75 CCR2 (0.68) CCR2RAB9ANPC1ALDH1A1KDM4E
SCHEMBL7973568 0.73 CCR2 (0.66) CCR2RAB9ANPC1ALDH1A1KDM4E
SCHEMBL7238858 0.73 CCR2 (0.71) CCR2RAB9ANPC1ALDH1A1KDM4E
SCHEMBL3954242 0.73 CCR2 (0.69) CCR2RAB9ANPC1ALDH1A1
SCHEMBL8317734 0.73 CCR2 (0.69) CCR2RAB9ANPC1ALDH1A1
SCHEMBL7973572 0.73 CCR2 (0.66) CCR2RAB9ANPC1ALDH1A1KDM4E

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-7569562-B2 N-substituted heterocyclic sulfonamides ELAN PHARMACEUTICALS, INC. (US) 2009-08-04 US claimed
EP-1838701-A1 N-SUBSTITUTED HETEROCYCLIC SULFONAMIDES Elan Pharmaceuticals Inc. (US) 2007-10-03 EP claimed
US-20060270657-A1 N-substituted heterocyclic sulfonamides ELAN PHARMACEUTICALS, INC. 2006-11-30 US claimed
WO-2006078753-A1 N-SUBSTITUTED HETEROCYCLIC SULFONAMIDES ELAN PHARMACEUTICALS, INC. (US) 2006-07-27 WO claimed
US-7569562-B2 N-substituted heterocyclic sulfonamides ELAN PHARMACEUTICALS, INC. (US) 2009-08-04 US disclosed
EP-1838701-A1 N-SUBSTITUTED HETEROCYCLIC SULFONAMIDES Elan Pharmaceuticals Inc. (US) 2007-10-03 EP disclosed
US-20060270657-A1 N-substituted heterocyclic sulfonamides ELAN PHARMACEUTICALS, INC. 2006-11-30 US disclosed
WO-2006078753-A1 N-SUBSTITUTED HETEROCYCLIC SULFONAMIDES ELAN PHARMACEUTICALS, INC. (US) 2006-07-27 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-20060270657-A1 N-substituted heterocyclic sulfonamides SULT2A1, PSEN1, PSEN2 CCR2 1834/4885RAB9A 2447/4885NPC1 300/4885

“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.