SCHEMBL10069756

SCHEMBL10069756

NC(=O)C(CCCF)NCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 4/20 0.49
PDE4A P27815 2/20 0.43
PADI1 Q9ULC6 2/20 0.43
PADI4 Q9UM07 2/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43
PDE4D Q08499 1/20 0.43
PADI2 Q9Y2J8 1/20 0.43
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41
PADI3 Q9ULW8 1/20 0.41
TMPRSS11D O60235 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
SCHEMBL8526415 0.89 TLR2 (0.56) TLR2CYP1A2CYP2D6CYP2C9TSHR
SCHEMBL8526421 0.89 TLR2 (0.56) TLR2CYP1A2CYP2D6CYP2C9TSHR
SCHEMBL7272134 0.85 TLR2 (0.58) TLR2
SCHEMBL15669228 0.83 TLR2 (0.43) TLR2
SCHEMBL15669229 0.83 TLR2 (0.43) TLR2
SCHEMBL26523520 0.82 CYP1A2 (0.47) TLR2CYP1A2CYP2D6CYP2C9TSHR
SCHEMBL1688370 0.82 ALDH1A1 (0.42) TLR2
SCHEMBL10070276 0.82 ALDH1A1 (0.42) TLR2
SCHEMBL27656566 0.81 TLR2 (0.51) TLR2TMPRSS11D
SCHEMBL2251929 0.81 MEP1B (0.52)

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-8093276-B2 Alpha-(N-sulfonamido)acetamide compound as an inhibitor of beta amyloid peptide production BRISTOL-MYERS SQUIBB COMPANY (US) 2012-01-10 US disclosed
US-20090227642-A1 NOVEL ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUND AS AN INHIBITOR OF BETA AMYLOID PEPTIDE PRODUCTION BRISTOL-MYERS SQUIBB COMPANY 2009-09-10 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-20090227642-A1 NOVEL ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUND AS AN INHIBITOR OF BETA AMYLOID PEPTIDE PRODUCTION APP, BACE1, APBA1 TLR2 4009/4885PDE4A 719/4885PADI1 1299/4885

“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.