SCHEMBL8025974

SCHEMBL8025974

CCC(C(=O)O)N1Cc2sc(-c3ccc(/C=C/c4ccc(-c5ccccc5)cc4)cc3)cc2S1(=O)=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 3/20 0.35
MMP2 P08253 2/20 0.35
MMP9 P14780 2/20 0.35
TP53 P04637 2/20 0.34
MAPT P10636 2/20 0.34
BCHE P06276 1/20 0.34
HDAC2 Q92769 2/20 0.33
ESR1 P03372 1/20 0.32
GRIK1 P39086 1/20 0.32
GRIK2 Q13002 1/20 0.32
HDAC1 Q13547 2/20 0.32
HDAC6 Q9UBN7 2/20 0.32
HDAC4 P56524 1/20 0.32
MMP3 P08254 1/20 0.32
MMP8 P22894 1/20 0.32
MMP13 P45452 1/20 0.32
MMP14 P50281 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
HRH3 Q9Y5N1 2/20 0.32

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
SCHEMBL13786691 0.97 MAPT (0.33) MMP1MMP2MMP9TP53MAPT
SCHEMBL8028979 0.94 MAPT (0.37) MMP1MMP2MMP9TP53MAPT
SCHEMBL8027659 0.92 GRIK1 (0.31) TP53MAPTGRIK1GRIK2RAB9A
SCHEMBL8025882 0.92 MMP1 (0.37) MMP1MMP2MMP9TP53MAPT
SCHEMBL13786795 0.92 MAPT (0.39) MMP1MMP2MMP9TP53MAPT
SCHEMBL8025421 0.91 KDM4E (0.33) MAPTGRIK1GRIK2NPC1RAB9A
SCHEMBL13786765 0.91 PTPN1 (0.35) MAPTHDAC2GRIK1GRIK2NPC1
SCHEMBL8018472 0.91 MMP1 (0.35) MMP1MMP2MMP9BCHEHDAC2
SCHEMBL13786729 0.89 KDM4E (0.39) MMP1TP53MAPTHDAC2HDAC1
SCHEMBL13786798 0.89 PTPN1 (0.37) MMP1HDAC2GRIK1GRIK2HDAC1

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 MMP1 13/4885MMP2 31/4885MMP9 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.