SCHEMBL4049341

SCHEMBL4049341

C=CCNC(=O)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.69
HPGD P15428 3/20 0.69
ALDH1A1 P00352 2/20 0.69
PKM P14618 1/20 0.68
SMN1; SMN2 Q16637 3/20 0.65
RAB9A P51151 2/20 0.65
HTT P42858 2/20 0.65
GLA P06280 1/20 0.65
GAA P10253 1/20 0.65
MMP1 P03956 1/20 0.60
CA12 O43570 1/20 0.57
CA1 P00915 1/20 0.57
CA2 P00918 1/20 0.57
MMP2 P08253 1/20 0.57
CA9 Q16790 1/20 0.57
MAPK14 Q16539 4/20 0.56
CYP3A4 P08684 1/20 0.56
MMP13 P45452 1/20 0.56
PGR P06401 1/20 0.55
MAPT P10636 1/20 0.54

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
SCHEMBL83922 0.85 HPGD (0.86) LMNAHPGDALDH1A1PKMSMN1; SMN2
SCHEMBL2385213 0.83 HPGD (0.76) LMNAHPGDALDH1A1PKMSMN1; SMN2
SCHEMBL4800405 0.82 HPGD (1.00) LMNAHPGDALDH1A1PKMSMN1; SMN2
SCHEMBL13113851 0.81 PKM (1.00) LMNAHPGDALDH1A1PKMSMN1; SMN2
SCHEMBL16508287 0.79 ALDH1A1 (0.58) LMNAHPGDALDH1A1SMN1; SMN2RAB9A
SCHEMBL13754242 0.79 HPGD (0.66) LMNAHPGDALDH1A1SMN1; SMN2RAB9A
SCHEMBL1222467 0.79 MMP1 (0.74) LMNAHPGDALDH1A1SMN1; SMN2HTT
SCHEMBL19835597 0.78 MMP13 (0.74) LMNAHPGDALDH1A1SMN1; SMN2RAB9A
SCHEMBL11760375 0.78 CA12 (0.68) LMNAHPGDALDH1A1SMN1; SMN2RAB9A
SCHEMBL9239630 0.78 CA12 (0.68) LMNAHPGDALDH1A1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1397137-B1 HYDANTION DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES BRISTOL MYERS SQUIBB CO (US) 2009-10-14 EP disclosed
US-7482372-B2 Hydantoins and related heterocycles as inhibitors of matrix metalloproteinases and/or TNF-α converting enzyme (TACE) BRISTOL-MYERS SQUIBB COMPANY (US) 2009-01-27 US disclosed
US-20050171096-A1 Hydantoins and related heterocycles as inhibitors of matrix metalloproteinases and/or TNF-alpha converting enzyme (TACE) SHEPPECK JAMES E (US) 2005-08-04 US disclosed
US-6906053-B2 Hydantoins and related heterocycles as inhibitors of matrix metalloproteinases and/or TNF-α converting enzyme (TACE) BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2005-06-14 US disclosed
US-6890915-B2 Hydantoins and related heterocycles as inhibitors of matrix metalloproteinases and/or TNF-α converting enzyme (TACE) BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2005-05-10 US disclosed
US-20040209874-A1 Hydantoins and related heterocycles as inhibitors of matrix metalloproteinases and/or TNF-alpha converting enzyme (TACE) SHEPPECK JAMES E (US) 2004-10-21 US disclosed
EP-1397137-A4 HYDANTION DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES BRISTOL MYERS SQUIBB CO (US) 2004-10-13 EP disclosed
EP-1397137-A1 HYDANTION DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES BRISTOL-MYERS SQUIBB COMPANY (US) 2004-03-17 EP disclosed
US-20030130273-A1 Hydantoins and related heterocycles as inhibitors of matrix metalloproteinases and/or TNF-alpha converting enzyme (TACE) BRISTOL-MYERS SQUIBB PHARMA COMPANY 2003-07-10 US disclosed
WO-2002096426-A1 HYDANTION DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES BRISTOL-MYERS SQUIBB COMPANY (US) 2002-12-05 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 (3 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-20040209874-A1 Hydantoins and related heterocycles as inhibitors of matrix metalloproteinases and/or TNF-alpha converting enzyme (TACE) ADAM17, ADAMTS1, ADAM8 LMNA 1053/4885HPGD 63/4885ALDH1A1 701/4885
US-20050171096-A1 Hydantoins and related heterocycles as inhibitors of matrix metalloproteinases and/or TNF-alpha converting enzyme (TACE) ADAM17, ADAMTS1, ADAM9 LMNA 860/4885HPGD 70/4885ALDH1A1 600/4885
US-20030130273-A1 Hydantoins and related heterocycles as inhibitors of matrix metalloproteinases and/or TNF-alpha converting enzyme (TACE) ADAM17, ADAMTS1, ADAM8 LMNA 1053/4885HPGD 63/4885ALDH1A1 701/4885

“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.