SCHEMBL3600422

SCHEMBL3600422

O=Cc1cc(-c2ccc(Cl)cc2)sc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.56
PTPRA P18433 1/20 0.56
IKBKB O14920 2/20 0.51
MAPT P10636 3/20 0.50
ALDH1A1 P00352 2/20 0.50
POLB P06746 2/20 0.50
ACLY P53396 1/20 0.50
KDM4E B2RXH2 4/20 0.48
RAB9A P51151 3/20 0.48
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
GAA P10253 1/20 0.48
GFER P55789 1/20 0.48
NPC1 O15118 2/20 0.47
CASP3 P42574 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
NPSR1 Q6W5P4 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL12409619 0.85 PTPRF (0.53) PTPN1IKBKBMAPTALDH1A1POLB
SCHEMBL6348871 0.84 PTPN1 (0.56) PTPN1PTPRAIKBKBMAPTPOLB
SCHEMBL4379744 0.80 PTPN1 (0.49) PTPN1PTPRAIKBKBMAPTALDH1A1
SCHEMBL2276857 0.80 PTPN1 (0.49) PTPN1PTPRAIKBKBMAPTALDH1A1
SCHEMBL2176910 0.78 PTPN1 (0.58) PTPN1PTPRAIKBKBMAPTALDH1A1
SCHEMBL1144476 0.78 IKBKB (0.77) PTPN1PTPRAIKBKBMAPTALDH1A1
SCHEMBL4870380 0.78 PTPN1 (0.58) PTPN1PTPRAIKBKBMAPTALDH1A1
SCHEMBL17226318 0.74 PTPN1 (0.70) PTPN1PTPRAIKBKBMAPTALDH1A1
SCHEMBL2169644 0.74 PTPN1 (0.55) PTPN1PTPRAIKBKBMAPTALDH1A1
SCHEMBL4194300 0.73 PTPN1 (0.53) PTPN1PTPRAIKBKBMAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723331-B2 Thienopyrimidine compounds and uses thereof ASTRAZENECA AB (SE) 2010-05-25 US disclosed
US-7723331-B2 Thienopyrimidine compounds and uses thereof ASTRAZENECA AB (SE) 2010-05-25 US disclosed
US-7723331-B2 Thienopyrimidine compounds and uses thereof ASTRAZENECA AB (SE) 2010-05-25 US disclosed
EP-2121703-A1 THIENOPYRIMIDIN-4-ONE AND THIENOPYRIDAZIN-7-ONE DERIVATIVES AS MCH RL ANTAGONISTS AstraZeneca AB (SE) 2009-11-25 EP disclosed
CN-101528751-A Thienopyrimidin-4-one and thienopyridazin-7-one derivatives as MCH Rl antagonists ASTRAZENECA AB (SE) 2009-09-09 CN disclosed
US-20080221107-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-09-11 US disclosed
EP-1907398-A1 THERAPEUTIC AGENTS AstraZeneca AB (SE) 2008-04-09 EP disclosed
US-20080051405-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-02-28 US disclosed
US-20080051405-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-02-28 US disclosed
US-20080051405-A1 Therapeutic Agents ASTRAZENECA AB (SE) 2008-02-28 US disclosed
WO-2008020799-A1 THIENOPYRIMIDIN-4-ONE AND THIENOPYRIDAZIN-7-ONE DERIVATIVES AS MCH RL ANTAGONISTS ASTRAZENECA AB (SE) 2008-02-21 WO disclosed
WO-2008020799-A1 THIENOPYRIMIDIN-4-ONE AND THIENOPYRIDAZIN-7-ONE DERIVATIVES AS MCH RL ANTAGONISTS ASTRAZENECA AB (SE) 2008-02-21 WO disclosed
WO-2007011284-A1 THERAPEUTIC AGENTS ASTRAZENECA AB (SE) 2007-01-25 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 (2 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-20080051405-A1 Therapeutic Agents GPR119, HTT, IAPP PTPN1 4648/4885PTPRA 3115/4885IKBKB 1388/4885
US-20080221107-A1 Therapeutic Agents HTT, ACHE, GRIN2A PTPN1 4747/4885PTPRA 3315/4885IKBKB 1120/4885

“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.