SCHEMBL6633253

SCHEMBL6633253

N#Cc1cc2c(S)c(C(=O)NCc3ccc(Cl)cc3)cnc2s1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
NR3C1 P04150 2/20 0.42
AKR1B1 P15121 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
LMNA P02545 1/20 0.40
POLA1 P09884 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL6710933 0.89 SMN1; SMN2 (0.46) SMN1; SMN2NR3C1AKR1B1RXFP1KDM4E
SCHEMBL6339252 0.88 SMN1; SMN2 (0.34) SMN1; SMN2NR3C1AKR1B1RXFP1ALDH1A1
SCHEMBL6633657 0.87 SMN1; SMN2 (0.41) SMN1; SMN2NR3C1RXFP1CYP1A2CYP2C9
SCHEMBL6636279 0.85 SMN1; SMN2 (0.40) SMN1; SMN2NR3C1CYP1A2CYP2C9HPGD
SCHEMBL6635365 0.84 SMN1; SMN2 (0.45) SMN1; SMN2NR3C1RXFP1KDM4ENPC1
SCHEMBL6633650 0.84 NR3C1 (0.44) SMN1; SMN2NR3C1AKR1B1RXFP1KDM4E
SCHEMBL6635451 0.84 SMN1; SMN2 (0.39) SMN1; SMN2NR3C1RXFP1KDM4EALDH1A1
SCHEMBL6631493 0.84 SMN1; SMN2 (0.45) SMN1; SMN2NR3C1HPGDLMNA
SCHEMBL6631936 0.83 RXFP1 (0.46) SMN1; SMN2NR3C1RXFP1CYP1A2CYP2C9
SCHEMBL6631743 0.80 RXFP1 (0.43) SMN1; SMN2NR3C1RXFP1ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1421089-A1 4-THIOXO-4,7-DIHYDRO-THIENO 2,3-b]PYRIDINE-5-CARBOXAMIDES AS ANTIVIRAL AGENTS Pharmacia & Upjohn Company (US) 2004-05-26 EP claimed
US-6620810-B2 Treating a herpesvirus infection, atherosclerosis or restenosis PHARMACIA & UPJOHN COMPANY 2003-09-16 US claimed
US-20030109542-A1 4-thioxo-4,7-dihydro-thieno[2,3-b]pyridine-5-carboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2003-06-12 US claimed
WO-2003020729-A1 4-THIOXO-4,7-DIHYDRO-THIENO[2,3-b]PYRIDINE-5-CARBOXAMIDES AS ANT IVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2003-03-13 WO claimed
EP-1421089-A1 4-THIOXO-4,7-DIHYDRO-THIENO 2,3-b]PYRIDINE-5-CARBOXAMIDES AS ANTIVIRAL AGENTS Pharmacia & Upjohn Company (US) 2004-05-26 EP disclosed
US-6620810-B2 Treating a herpesvirus infection, atherosclerosis or restenosis PHARMACIA & UPJOHN COMPANY 2003-09-16 US disclosed
US-20030109542-A1 4-thioxo-4,7-dihydro-thieno[2,3-b]pyridine-5-carboxamides as antiviral agents PHARMACIA & UPJOHN COMPANY 2003-06-12 US disclosed
WO-2003020729-A1 4-THIOXO-4,7-DIHYDRO-THIENO[2,3-b]PYRIDINE-5-CARBOXAMIDES AS ANT IVIRAL AGENTS PHARMACIA & UPJOHN COMPANY (US) 2003-03-13 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-20030109542-A1 4-thioxo-4,7-dihydro-thieno[2,3-b]pyridine-5-carboxamides as antiviral agents IRF3, IRAK4, IFNAR1 SMN1; SMN2 3879/4885NR3C1 1076/4885AKR1B1 2262/4885

“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.