SCHEMBL3148911

SCHEMBL3148911

O=C(CN1CCN(C(=O)c2ccc(S(=O)(=O)Nc3ccccc3Oc3ccc(Cl)c(Cl)c3)cc2)CC1)N1CCOCC1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
GAA P10253 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
PKM P14618 2/20 0.44
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 1/20 0.43
TSHR P16473 1/20 0.43
KMT2A Q03164 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CCR2 P41597 1/20 0.42
POLB P06746 1/20 0.42

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
SCHEMBL3149459 0.93 L3MBTL1 (0.49) ALDH1A1GAASMN1; SMN2PKMMAPK1
SCHEMBL3149140 0.92 L3MBTL1 (0.50) ALDH1A1GAASMN1; SMN2PKMMAPK1
SCHEMBL3153219 0.92 KMT2A (0.51) ALDH1A1GAASMN1; SMN2PKMMAPK1
SCHEMBL3143520 0.90 KMT2A (0.49) ALDH1A1GAASMN1; SMN2PKMMAPK1
SCHEMBL3153442 0.88 L3MBTL1 (0.45) ALDH1A1GAAKMT2AL3MBTL1CCR2
SCHEMBL3154567 0.87 CCR2 (0.48) ALDH1A1GAASMN1; SMN2PKMMAPK1
SCHEMBL3157725 0.87 CCR2 (0.55) ALDH1A1GAASMN1; SMN2PKMMAPK1
SCHEMBL3153568 0.86 CCR2 (0.57) ALDH1A1GAASMN1; SMN2PKMMAPK1
SCHEMBL3156345 0.84 CCR2 (0.54) ALDH1A1GAASMN1; SMN2PKMMAPK1
SCHEMBL3148226 0.84 ALDH1A1 (0.47) ALDH1A1GAASMN1; SMN2PKMMAPK1

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 ALDH1A1 3552/4885GAA 4410/4885SMN1; SMN2 3719/4885

“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.