SCHEMBL3148944

SCHEMBL3148944

O=C(NCCCN1CCCCC1)c1ccc(S(=O)(=O)Nc2ccccc2Oc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 9/20 0.59
CACNA1B Q00975 3/20 0.53
CACNA1H O95180 1/20 0.53
KCNH2 Q12809 2/20 0.52
HRH3 Q9Y5N1 3/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
PKM P14618 1/20 0.50
BDKRB1 P46663 1/20 0.49

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
SCHEMBL3147720 0.92 CCR2 (0.52) CCR2CACNA1BCACNA1HKCNH2HRH3
SCHEMBL3050672 0.86 CCR2 (0.53) CCR2KCNH2KDM4EALDH1A1PKM
SCHEMBL3149815 0.86 CCR2 (0.68) CCR2KCNH2KDM4E
SCHEMBL3149352 0.86 CCR2 (0.65) CCR2KCNH2ALDH1A1
SCHEMBL3153072 0.85 CCR2 (0.50) CCR2KCNH2KDM4EALDH1A1PKM
SCHEMBL3145962 0.85 CCR2 (0.51) CCR2CACNA1BCACNA1HKCNH2HRH3
SCHEMBL3145968 0.85 CCR2 (0.51) CCR2CACNA1BCACNA1HKCNH2HRH3
SCHEMBL3148923 0.84 L3MBTL3 (0.52) CCR2KCNH2KDM4EALDH1A1PKM
SCHEMBL3153707 0.83 CCR2 (0.53) CCR2CACNA1BCACNA1HKCNH2
SCHEMBL14430801 0.83 EPHX2 (0.61) CACNA1BCACNA1HHRH3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2074083-B1 NEW SULFONAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT (HU) 2013-06-19 EP disclosed
US-20100075978-A1 SULFONAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2010-03-25 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-20100075978-A1 SULFONAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS BDKRB1, BDKRB2, TRPV1 CCR2 417/4885CACNA1B 881/4885CACNA1H 1014/4885

“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.