SCHEMBL4320108

SCHEMBL4320108

CCC(=O)C(C)Cc1ccc(N2CC(=O)NS2(=O)=O)c(OCc2ccccc2)c1.[KH]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 7/20 0.41
PTPN2 P17706 1/20 0.38
ADAM17 P78536 2/20 0.36
MMP9 P14780 1/20 0.36
PTGER1 P34995 2/20 0.36
PTGER4 P35408 2/20 0.36
PTGER3 P43115 2/20 0.36
PTGER2 P43116 2/20 0.36
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
PKM P14618 1/20 0.34
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MMP1 P03956 1/20 0.33
HSD17B10 Q99714 1/20 0.33
APP P05067 1/20 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
SCHEMBL3915830 0.99 PTPN1 (0.42) PTPN1PTPN2ADAM17MMP9PTGER1
Potassium SCHEMBL4320111 0.98 PTPN1 (0.41) PTPN1PTPN2ADAM17MMP9PTGER1
SCHEMBL3928697 0.89 PTPN1 (0.41) PTPN1PTPN2ADAM17MMP9PTGER1
SCHEMBL3917093 0.88 PTPN1 (0.42) PTPN1PTPN2ADAM17MMP9PTGER1
Potassium SCHEMBL3929625 0.88 PTPN1 (0.41) PTPN1PTPN2ADAM17MMP9PTGER1
SCHEMBL3930874 0.84 PTPN1 (0.40) PTPN1PTPN2ADAM17MMP9MEN1
Potassium SCHEMBL3930878 0.83 PTPN1 (0.41) PTPN1PTPN2MEN1KMT2ASMN1; SMN2
SCHEMBL3926366 0.83 PTPN1 (0.41) PTPN1PTPN2MEN1KMT2ASMN1; SMN2
SCHEMBL3918219 0.82 PTPN1 (0.40) PTPN1PTPN2MEN1KMT2ASMN1; SMN2
SCHEMBL3918217 0.81 PTPN1 (0.43) PTPN1PTPN2

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-8084448-B2 Organic compounds NOVARTIS AG (CH) 2011-12-27 US disclosed
US-20090181928-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-07-16 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-20090181928-A1 ORGANIC COMPOUNDS PTPRS, PTPRO, PTPRC PTPN1 21/4885PTPN2 5/4885ADAM17 3560/4885

“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.