SCHEMBL7032302

SCHEMBL7032302

CCCOC(=O)C1SCC(CC)C1=O

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 1/20 0.35
PTPN1 P18031 1/20 0.35
PPP1CC P36873 1/20 0.35
MMP2 P08253 2/20 0.34
MMP9 P14780 2/20 0.34
MMP14 P50281 2/20 0.34
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.33
ALDH1A1 P00352 3/20 0.31
USP2 O75604 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL7030761 0.87 KDM4E (0.38) MMP2MMP9MMP14KDM4EALDH1A1
SCHEMBL7027941 0.83 PPM1B (0.36) PPM1BPTPN1PPP1CCMMP2MMP9
SCHEMBL7026744 0.82 KMT2A (0.35) ALDH1A1
SCHEMBL7024458 0.81 PPM1B (0.35) PPM1BPTPN1PPP1CCMMP2MMP9
SCHEMBL7027869 0.81 MMP2 (0.33) PPM1BPTPN1PPP1CCMMP2MMP9
SCHEMBL7027872 0.81 MMP2 (0.33) PPM1BPTPN1PPP1CCMMP2MMP9
SCHEMBL7029452 0.78 PPM1B (0.33) PPM1BPTPN1PPP1CCMMP2MMP9
SCHEMBL7030167 0.70 PPM1B (0.33) PPM1BPTPN1PPP1CCMMP2MMP9
SCHEMBL7033442 0.70 PPM1B (0.33) PPM1BPTPN1PPP1CCMMP2MMP9
SCHEMBL7034548 0.69 KDM4E (0.38) KDM4EALDH1A1

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-20030162979-A1 Substituted sulphonylamino(thio)carbonyl compounds MULLER KLAUS-HELMUT (DE) 2003-08-28 US disclosed
US-6441195-B1 2-ALKOXYCARBONYL-3-SULPHONAMIDE, SULPHONYL ISOCYANATE OR SULPHONYL ISOTHIOCYANATE-THIOPHENES; PRE- OR POSTEMERGENCE HERBICIDES; EFFICIENCY BAYER AKTIENGESELLSCHAFT (DE) 2002-08-27 US disclosed
US-6180567-B1 REACTING 2-ALKOXYCARBONYL-BENZENESULFONAMIDE DERIVATIVE WITH 1,2,4-(1H)TRIAZOLE-5-(THI)ONE DERIVATIVE BAYER AKTIENGESELLSCHAFT (DE) 2001-01-30 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-20030162979-A1 Substituted sulphonylamino(thio)carbonyl compounds CBR3, CTH, CBR1 PPM1B 3549/4885PTPN1 1749/4885PPP1CC 4506/4885

“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.