SCHEMBL4701093

SCHEMBL4701093

Oc1cccc(/C=C/c2ccc(Cl)cc2)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 2/20 0.64
MMP1 P03956 2/20 0.58
MMP2 P08253 2/20 0.58
MMP9 P14780 2/20 0.58
CCNB2 O95067 1/20 0.53
CDK1 P06493 1/20 0.53
CDK4 P11802 1/20 0.53
CCNB1 P14635 1/20 0.53
CCND1 P24385 1/20 0.53
CCNB3 Q8WWL7 1/20 0.53
ABL1 P00519 1/20 0.53
BCR P11274 1/20 0.53
AHR P35869 1/20 0.52
ALOX5 P09917 1/20 0.52
PTGS1 P23219 1/20 0.52
PTGS2 P35354 1/20 0.52
APP P05067 1/20 0.52
RELA Q04206 1/20 0.51
TSHR P16473 1/20 0.50
MAOB P27338 1/20 0.49

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
SCHEMBL4701094 1.00 LCK (0.64) LCKMMP1MMP2MMP9CCNB2
SCHEMBL8967713 0.86 LCK (0.67) LCKMMP1MMP2MMP9CCNB2
SCHEMBL8967718 0.86 LCK (0.67) LCKMMP1MMP2MMP9CCNB2
(E)-3,4'-Stilbendiol SCHEMBL29798835 0.85 LCK (0.72) LCKMMP1MMP2MMP9CCNB2
(E)-3,4'-Stilbendiol SCHEMBL720093 0.85 LCK (0.72) LCKMMP1MMP2MMP9CCNB2
(E)-3,4'-Stilbendiol SCHEMBL4167479 0.85 LCK (0.72) LCKMMP1MMP2MMP9CCNB2
(E)-3,4'-Stilbendiol SCHEMBL720092 0.85 LCK (0.72) LCKMMP1MMP2MMP9CCNB2
SCHEMBL13338339 0.85 LCK (0.86) LCKCCNB2CDK1CDK4CCNB1
SCHEMBL2512334 0.85 LCK (0.86) LCKCCNB2CDK1CDK4CCNB1
SCHEMBL2512336 0.85 LCK (0.86) LCKCCNB2CDK1CDK4CCNB1

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
US-5530030-A CHLORINATED HYDROXYSTILBENES KIORITZ CORPORATIN (JP) 1996-06-25 US claimed
EP-1926737-B1 4-AMINO-THIENO[3,2-C]PYRIDINE-7-CARBOXYLIC ACID DERIVATIVES HOFFMANN LA ROCHE (CH) 2017-03-15 EP disclosed
CN-101263145-A 4-amino-thieno [3, 2-C ] pyridine-7-carboxylic acid derivatives HOFFMANN LA ROCHE (CH) 2008-09-10 CN disclosed
EP-1926737-A1 4-AMINO-THIENO[3,2-C]PYRIDINE-7-CARBOXYLIC ACID DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-06-04 EP disclosed
WO-2007031428-A1 4-AMINO-THIENO[3,2-C]PYRIDINE-7-CARBOXYLIC ACID DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-03-22 WO disclosed
US-20070060607-A1 4-amino-thieno[3,2-c] pyridine-7-carboxylic acid derivatives BARTKOVITZ DAVID J 2007-03-15 US disclosed
US-5530030-A CHLORINATED HYDROXYSTILBENES KIORITZ CORPORATIN (JP) 1996-06-25 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-20070060607-A1 4-amino-thieno[3,2-c] pyridine-7-carboxylic acid derivatives BRAF, RAF1, MAP3K7 LCK 99/4885MMP1 4684/4885MMP2 3357/4885

“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.