SCHEMBL6937033

SCHEMBL6937033

NC(=O)CC(CCC1CCCC1)C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.43
EPHX1 P07099 4/20 0.38
ALOX5 P09917 3/20 0.36
HPGD P15428 1/20 0.33
METAP2 P50579 1/20 0.33
BMP1 P13497 2/20 0.32
PDE4A P27815 1/20 0.32
PDE4B Q07343 1/20 0.32
PDE4C Q08493 1/20 0.32
PDE4D Q08499 1/20 0.32
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32

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
SCHEMBL5197131 0.80 CA1 (0.48) METAP1EPHX1ALOX5HPGDMETAP2
SCHEMBL8426469 0.79 ALDH1A1 (0.37) METAP1EPHX1HPGDMETAP2BMP1
SCHEMBL9576 0.76 METAP1 (0.46) METAP1EPHX1ALOX5HPGDMETAP2
SCHEMBL10801322 0.73 EPHX1 (0.45) EPHX1ALOX5
SCHEMBL21540294 0.73 METAP1 (0.55) METAP1EPHX1ALOX5HPGDMETAP2
SCHEMBL10305559 0.73 METAP1 (0.55) METAP1EPHX1ALOX5HPGDMETAP2
SCHEMBL7349947 0.72 TDP1 (0.35) EPHX1ALOX5
SCHEMBL8895135 0.72 TDP1 (0.35) EPHX1ALOX5
SCHEMBL6938015 0.72 TDP1 (0.35) EPHX1ALOX5
SCHEMBL5378916 0.72 METAP1 (0.48) METAP1EPHX1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313426-A2 SUCCINOYLAMINO BENZODIAZEPINES AS INHIBITORS OF A-BETA PROTEIN PRODUCTION Bristol-Myers Squibb Pharma Company (US) 2003-05-28 EP disclosed
EP-1313426-A4 SUCCINOYLAMINO BENZODIAZEPINES AS INHIBITORS OF A-BETA PROTEIN PRODUCTION BRISTOL MYERS SQUIBB PHARMA CO (US) 2003-05-28 EP disclosed
WO-2000038618-A2 SUCCINOYLAMINO BENZODIAZEPINES AS INHIBITORS OF Aβ PROTEIN PRODUCTION DU PONT PHARMACEUTICALS COMPANY (US) 2000-07-06 WO disclosed