SCHEMBL10280595

SCHEMBL10280595

O=C(/C=C/c1ccccc1)NC(CO)c1ccc(F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 3/20 0.56
▸ MMP1 P03956 1/20 0.56
▸ MMP2 P08253 1/20 0.56
▸ MMP9 P14780 1/20 0.56
▸ UTS2R Q9UKP6 3/20 0.55
▸ ALDH1A1 P00352 3/20 0.54
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ TDP1 Q9NUW8 1/20 0.52
▸ NOS3 P29474 1/20 0.52
▸ NOS1 P29475 1/20 0.52
▸ NOS2 P35228 1/20 0.52
▸ KMT2A Q03164 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ HTT P42858 2/20 0.50
▸ MAPT P10636 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ CNR2 P34972 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ HDAC3 O15379 1/20 0.47
▸ HDAC4 P56524 1/20 0.47

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
SCHEMBL5870780 0.85 UTS2R (0.60) EGFRMMP1MMP2MMP9UTS2R
SCHEMBL5676173 0.85 UTS2R (0.60) EGFRMMP1MMP2MMP9UTS2R
SCHEMBL30794394 0.85 UTS2R (0.60) EGFRMMP1MMP2MMP9UTS2R
SCHEMBL5870782 0.85 UTS2R (0.60) EGFRMMP1MMP2MMP9UTS2R
SCHEMBL30794873 0.78 UTS2R (0.58) MMP1MMP2MMP9UTS2RALDH1A1
SCHEMBL5871018 0.78 UTS2R (0.58) MMP1MMP2MMP9UTS2RALDH1A1
SCHEMBL5673078 0.78 UTS2R (0.58) MMP1MMP2MMP9UTS2RALDH1A1
SCHEMBL5871012 0.78 UTS2R (0.58) MMP1MMP2MMP9UTS2RALDH1A1
SCHEMBL5673084 0.78 UTS2R (0.58) MMP1MMP2MMP9UTS2RALDH1A1
SCHEMBL6124750 0.78 NOS3 (0.47) EGFRMMP1MMP2MMP9UTS2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120107328-A1 GAMMA SECRETASE MODULATORS MERCK SHARP & DOHME CORP. 2012-05-03 — — 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-20120107328-A1 GAMMA SECRETASE MODULATORS BACE1, BACE2, PSEN1 EGFR 4146/4885MMP1 2606/4885MMP2 651/4885

“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.

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