SCHEMBL3143897

SCHEMBL3143897

O=C(NCCN1CCN(c2cnccn2)CC1)c1ccc(S(=O)(=O)Nc2ccccc2Oc2ccc(Br)cc2Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 16/20 0.47
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
TSHR P16473 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KCNH2 Q12809 2/20 0.43

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
SCHEMBL3149208 0.91 CCR2 (0.49) CCR2KDM4EALDH1A1GAATSHR
SCHEMBL3153218 0.89 CCR2 (0.49) CCR2KDM4EALDH1A1GAATSHR
SCHEMBL3149811 0.87 CCR2 (0.54) CCR2KDM4EALDH1A1GAATSHR
SCHEMBL15016167 0.85 CCR2 (0.54) CCR2KDM4EALDH1A1KCNH2
SCHEMBL3140818 0.83 CCR2 (0.52) CCR2KDM4EALDH1A1GAATSHR
SCHEMBL15104125 0.82 KDM4E (0.45) CCR2KDM4EALDH1A1TSHRSMN1; SMN2
SCHEMBL3156881 0.82 CCR2 (0.48) CCR2KCNH2
SCHEMBL15016181 0.82 SMN1; SMN2 (0.43) CCR2ALDH1A1GAASMN1; SMN2
SCHEMBL3155058 0.81 CCR2 (0.49) CCR2KDM4EALDH1A1GAATSHR
SCHEMBL15016259 0.81 CCR2 (0.55) CCR2KDM4EALDH1A1GAATSHR

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
EP-2074083-B1 NEW SULFONAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT (HU) 2013-06-19 EP claimed
US-20100075978-A1 SULFONAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2010-03-25 US claimed
EP-2074083-B1 NEW SULFONAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT (HU) 2013-06-19 EP 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 417/4885KDM4E 4035/4885ALDH1A1 3552/4885

“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.