SCHEMBL3709967

SCHEMBL3709967

CCCCc1nc(C)n(-c2ncc(O)cn2)c(=O)c1Cc1ccc(Br)cc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
APLNR P35414 2/20 0.38
NPC1 O15118 2/20 0.37
NFKB1 P19838 2/20 0.37
RAB9A P51151 2/20 0.37
NFKB2 Q00653 2/20 0.37
RELA Q04206 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
GAA P10253 1/20 0.37
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL3704767 0.88 APLNR (0.37) APLNRNPC1NFKB1RAB9ANFKB2
SCHEMBL3706760 0.88 APLNR (0.43) APLNRNPC1NFKB1RAB9ANFKB2
SCHEMBL3708521 0.86 POLB (0.37) APLNRNPC1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL3710810 0.85 APLNR (0.35) APLNRNPC1NFKB1RAB9ANFKB2
SCHEMBL3708894 0.85 APLNR (0.35) APLNRNPC1NFKB1RAB9ANFKB2
SCHEMBL504006 0.81 APLNR (0.43) APLNR
SCHEMBL3713241 0.79 APLNR (0.38) APLNRNPC1NFKB1RAB9ANFKB2
SCHEMBL503935 0.79 AGTR1 (0.42)
SCHEMBL503674 0.78 AGTR1 (0.44)
SCHEMBL3711008 0.76 APLNR (0.35) APLNRNPC1NFKB1RAB9ANFKB2

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-2471782-A1 NOVEL SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL PRODUCT CONTAINING SAME Kowa Company, Ltd. (JP) 2012-07-04 EP disclosed
US-20120122906-A1 NOVEL SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL PRODUCT CONTAINING SAME KOWA COMPANY, LTD. (JP) 2012-05-17 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-20120122906-A1 NOVEL SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL PRODUCT CONTAINING SAME AGTR2, AGTR1, PPARA APLNR 268/4885NPC1 2873/4885NFKB1 1800/4885

“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.