SCHEMBL1268812

SCHEMBL1268812

CC(C)CNc1nc(NS(=O)(=O)c2ccc(Cl)cc2Cl)ncc1Sc1ccc(S(=O)(=O)N2CCCCC2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 4/20 0.40
▸ ALDH1A1 P00352 4/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ MERTK Q12866 2/20 0.39
▸ MAPK1 P28482 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ POLB P06746 2/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ AXL P30530 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ SLC40A1 Q9NP59 1/20 0.36
▸ CCR4 P51679 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ OPRM1 P35372 1/20 0.35
▸ OPRK1 P41145 1/20 0.35

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
SCHEMBL13801186 0.94 PDE5A (0.39) PDE5AALDH1A1MEN1LMNAKMT2A
SCHEMBL1268621 0.93 ALDH1A1 (0.38) ALDH1A1MEN1LMNAKMT2AMERTK
SCHEMBL12930066 0.93 PDE5A (0.39) PDE5AALDH1A1MEN1LMNAKMT2A
SCHEMBL1268550 0.92 ALDH1A1 (0.40) ALDH1A1MEN1LMNAKMT2AMERTK
SCHEMBL1268539 0.92 ALDH1A1 (0.40) ALDH1A1MEN1LMNAKMT2AMERTK
SCHEMBL1269423 0.91 ALDH1A1 (0.39) PDE5AALDH1A1MEN1LMNAKMT2A
SCHEMBL1269882 0.89 PTGDR (0.42) ALDH1A1MEN1LMNAKMT2AMERTK
SCHEMBL1269566 0.88 ALDH1A1 (0.45) ALDH1A1MEN1LMNAKMT2AMERTK
SCHEMBL1268859 0.88 ALDH1A1 (0.39) ALDH1A1MEN1LMNAKMT2AMERTK
SCHEMBL1269687 0.88 PRKCQ (0.40) ALDH1A1MEN1LMNAKMT2AMERTK

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-7893077-B2 Bisaryl-sulfonamides AMGEN INC. (US) 2011-02-22 — — US disclosed
US-7893077-B2 Bisaryl-sulfonamides AMGEN INC. (US) 2011-02-22 — — US disclosed
EP-1786782-B1 BISARYL-SULFONAMIDES AMGEN INC (US) 2010-03-31 — — EP disclosed
US-20090221584-A1 Bisaryl-sulfonamides AMGEN INC. 2009-09-03 — — US disclosed
US-20090221584-A1 Bisaryl-sulfonamides AMGEN INC. 2009-09-03 — — US disclosed
US-7544702-B2 Bisaryl-sulfonamides AMGEN INC. (US) 2009-06-09 — — US disclosed
US-7544702-B2 Bisaryl-sulfonamides AMGEN INC. (US) 2009-06-09 — — US disclosed
US-20060084802-A1 Bisaryl-sulfonamides AMGEN INC. 2006-04-20 — — 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 (2 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-20090221584-A1 Bisaryl-sulfonamides PPARD, PPARA, PPARG PDE5A 3435/4885ALDH1A1 2237/4885MEN1 4841/4885
US-20060084802-A1 Bisaryl-sulfonamides PPARD, PPARA, PPARG PDE5A 3435/4885ALDH1A1 2237/4885MEN1 4841/4885

“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.

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