SCHEMBL788357

SCHEMBL788357

O=C(O)c1sc(Cl)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DAO P14920 5/20 0.50
MCL1 Q07820 4/20 0.40
BCKDK O14874 2/20 0.40
MAPK1 P28482 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
GPR35 Q9HC97 1/20 0.38
TTR P02766 1/20 0.38
BCL2L1 Q07817 1/20 0.38
TSHR P16473 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 1/20 0.38
GSK3B P49841 1/20 0.36
TPMT P51580 1/20 0.36
TP53 P04637 1/20 0.35
CASP1 P29466 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL5100241 0.79 MAPT (0.40) DAORXFP1ALDH1A1HPGDGSK3B
SCHEMBL18701713 0.79 DAO (0.65) DAOMCL1BCKDKMAPK1RXFP1
SCHEMBL18701701 0.77 BCKDK (0.43) DAOMCL1BCKDKMAPK1RXFP1
SCHEMBL154245 0.77 GPR35 (0.44) DAOMCL1BCKDKMAPK1RXFP1
SCHEMBL20439913 0.77 DAO (0.42) DAOMCL1BCKDKMAPK1RXFP1
SCHEMBL6592873 0.77 RXFP1 (0.48) DAOMCL1BCKDKMAPK1RXFP1
SCHEMBL3425861 0.77 DAO (0.48) DAOMCL1BCKDKMAPK1RXFP1
SCHEMBL9059332 0.77 DAO (0.38) DAOGSK3B
SCHEMBL18701642 0.77 DAO (0.47) DAOMCL1BCKDKMAPK1RXFP1
SCHEMBL28226525 0.77 DAO (0.47) DAOMCL1BCKDKRXFP1GPR35

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2616466-A2 PROCESS FOR DETERMINING THE SUITABILITY FOR DISTRIBUTION OF A BATCH OF A THIOPHENE-2-CARBOXAMIDE DERIVATIVE Medichem, S.A. (ES) 2013-07-24 EP claimed
WO-2012035057-A2 PROCESS FOR DETERMINING THE SUITABILITY FOR DISTRIBUTION OF A BATCH OF A THIOPHENE-2-CARBOXAMIDE DERIVATIVE MEDICHEM S.A. (ES) 2012-03-22 WO claimed
US-20180282605-A1 METHOD OF MONITORING A PARAMETER OF A HYDROCARBON WELL, PIPELINE OR FORMATION JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2018-10-04 US disclosed
WO-2017060699-A1 METHOD OF MONITORING A PARAMETER OF A HYDROCARBON WELL, PIPELINE OR FORMATION JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2017-04-13 WO disclosed
US-20130253187-A1 Process for Determining the Suitability for Distribution of a Batch of Thiophene-2-Carboxamide Derivative MEDICHEM, S.A. (ES) 2013-09-26 US disclosed
EP-2616466-A2 PROCESS FOR DETERMINING THE SUITABILITY FOR DISTRIBUTION OF A BATCH OF A THIOPHENE-2-CARBOXAMIDE DERIVATIVE Medichem, S.A. (ES) 2013-07-24 EP disclosed
WO-2012035057-A2 PROCESS FOR DETERMINING THE SUITABILITY FOR DISTRIBUTION OF A BATCH OF A THIOPHENE-2-CARBOXAMIDE DERIVATIVE MEDICHEM S.A. (ES) 2012-03-22 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-20130253187-A1 Process for Determining the Suitability for Distribution of a Batch of Thiophene-2-Carboxamide Derivative CYP2C9, CYP3A5, CYP3A43 DAO 2775/4885MCL1 3321/4885BCKDK 1039/4885

“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.