SCHEMBL12361918

SCHEMBL12361918

Cc1csc(S(=O)(=O)N(CC(C)F)c2cc3c(cc2OCc2ccc(C(=O)O)s2)CCC3)n1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MRGPRX4 Q96LA9 2/20 0.35
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ MEN1 O00255 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ NFKB1 P19838 1/20 0.31
▸ NFKB2 Q00653 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ RELA Q04206 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL12361825 0.92 NPC1 (0.33) MRGPRX4NPC1RAB9AMEN1ALDH1A1
SCHEMBL12380413 0.90 NPC1 (0.33) NPC1RAB9A
SCHEMBL12361961 0.88 NPC1 (0.33) NPC1RAB9AMEN1ALDH1A1LMNA
SCHEMBL12361885 0.87 RXRB (0.41) NPC1RAB9A
SCHEMBL12361897 0.86 TRPM8 (0.34) MRGPRX4NPC1RAB9A
SCHEMBL1645425 0.86 RXRB (0.41) NPC1RAB9A
SCHEMBL12361965 0.85 RXRA (0.45) NPC1RAB9A
SCHEMBL12361951 0.85 RXRA (0.45) NPC1RAB9A
SCHEMBL12361966 0.85 RXRA (0.45) NPC1RAB9A
SCHEMBL12361962 0.85 TRPM8 (0.34) NPC1RAB9AMEN1ALDH1A1LMNA

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
US-8314240-B2 Sulfonamide compounds or salts thereof ASTELLAS PHARMA INC. (JP) 2012-11-20 — — US disclosed
US-20110201616-A1 SULFONAMIDE COMPOUNDS OR SALTS THEREOF ASTELLAS PHARMA INC. (JP) 2011-08-18 — — 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-20110201616-A1 SULFONAMIDE COMPOUNDS OR SALTS THEREOF PTGER1, PTGER2, GPER1 MRGPRX4 142/4885NPC1 3550/4885RAB9A 3650/4885

“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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