SCHEMBL6875236

SCHEMBL6875236

COC(=O)c1cc(-c2ccc(NC(C)=O)cc2)cs1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.56
HTT P42858 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
ABL1 P00519 1/20 0.52
ALAD P13716 2/20 0.45
KMT2A Q03164 7/20 0.45
ALDH1A1 P00352 4/20 0.45
HPGD P15428 2/20 0.45
TSHR P16473 2/20 0.45
MEN1 O00255 4/20 0.44
KDM4E B2RXH2 3/20 0.44
MAPT P10636 2/20 0.44
PRKCZ Q05513 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44
CDK1 P06493 1/20 0.43
GAA P10253 1/20 0.43
GFER P55789 1/20 0.43
ERCC1 P07992 1/20 0.43
ERCC4 Q92889 1/20 0.43
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL6455231 0.88 ALAD (0.59) SMN1; SMN2HTTL3MBTL1ALADKMT2A
SCHEMBL6373405 0.82 MMP12 (0.52) SMN1; SMN2ABL1ALADKMT2AMAPT
SCHEMBL6882926 0.81 ALAD (0.50) ABL1ALADALDH1A1CA12CA1
SCHEMBL6664021 0.80 MMP12 (0.51) ABL1ALADALDH1A1HPGDKDM4E
SCHEMBL6704697 0.80 ALAD (0.71) SMN1; SMN2L3MBTL1ABL1ALADALDH1A1
SCHEMBL6368361 0.80 ALAD (0.71) SMN1; SMN2HTTL3MBTL1ABL1ALAD
SCHEMBL6369543 0.80 ALAD (0.49) ABL1ALADKMT2AALDH1A1HPGD
SCHEMBL6881198 0.80 OPRD1 (0.56) SMN1; SMN2L3MBTL1ABL1ALADALDH1A1
SCHEMBL2326735 0.80 HDAC6 (0.57) ABL1ALADKMT2AALDH1A1HPGD
SCHEMBL5033885 0.79 ABL1 (0.58) SMN1; SMN2HTTABL1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040072871-A1 Novel thiophene derivatives, their process of preparation and the pharmaceutical compositions which comprise them WARNER-LAMBERT COMPANY LLC 2004-04-15 US claimed
US-20040072871-A1 Novel thiophene derivatives, their process of preparation and the pharmaceutical compositions which comprise them WARNER-LAMBERT COMPANY LLC 2004-04-15 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-20040072871-A1 Novel thiophene derivatives, their process of preparation and the pharmaceutical compositions which comprise them MMP11, MMP13, CBR1 SMN1; SMN2 3494/4885HTT 3517/4885L3MBTL1 4717/4885

“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.