SCHEMBL8021276

SCHEMBL8021276

CCC(C(=O)O)N1Cc2sc(-c3ccc(OCc4ccccc4)cc3F)cc2S1(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 3/20 0.42
MMP1 P03956 1/20 0.42
MMP9 P14780 1/20 0.41
FFAR1 O14842 3/20 0.36
PPARD Q03181 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
S1PR1 P21453 2/20 0.35
S1PR3 Q99500 1/20 0.35
FFAR4 Q5NUL3 1/20 0.35
S1PR5 Q9H228 1/20 0.35
NOX1 Q9Y5S8 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.34
MAOB P27338 2/20 0.34
EDNRA P25101 1/20 0.34
ACACB O00763 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
PPARG P37231 1/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL8017413 0.87 NR4A2 (0.44) ADAM17MMP1MMP9PPARDMRGPRX4
SCHEMBL8025937 0.85 ADAM17 (0.40) ADAM17MMP1MMP9MRGPRX4FFAR4
SCHEMBL13786777 0.84 S1PR5 (0.39) ADAM17MMP1MMP9FFAR1PPARD
SCHEMBL8027488 0.82 PPARG (0.41) ADAM17MMP1MMP9FFAR1PPARD
SCHEMBL13786792 0.79 NPC1 (0.48)
SCHEMBL8030906 0.79 MRGPRX4 (0.41) ADAM17MMP1MMP9FFAR1PPARD
SCHEMBL8018469 0.78 MRGPRX4 (0.41) ADAM17MMP1MMP9FFAR1MRGPRX4
SCHEMBL13786795 0.77 MAPT (0.39) MMP1MMP9
SCHEMBL8027320 0.77 S1PR1 (0.38) ADAM17MMP1MMP9FFAR1S1PR1
SCHEMBL8027572 0.76 MMP1 (0.39) ADAM17MMP1MMP9FFAR1S1PR1

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
US-20090192154-A1 SULTAM DERIVATIVES ASAHI KASEI PHARMA CORPORATION (JP) 2009-07-30 US disclosed
US-20090192154-A1 SULTAM DERIVATIVES ASAHI KASEI PHARMA CORPORATION (JP) 2009-07-30 US disclosed
WO-2009084501-A1 SULTAM DERIVATIVE ASAHI KASEI PHARMA CORPORATION (JP) 2009-07-09 WO 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-20090192154-A1 SULTAM DERIVATIVES SULT1A1, SULT2A1, ADAMTS1 ADAM17 67/4885MMP1 13/4885MMP9 19/4885

“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.