SCHEMBL7387222

SCHEMBL7387222

CC(=O)OC1(N)CCCCC1F

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 1/20 0.31
▸ EP300 Q09472 1/20 0.30
▸ HIF1A Q16665 1/20 0.30
▸ CREBBP Q92793 1/20 0.30

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
SCHEMBL7390216 0.95 EP300 (0.33) EP300HIF1ACREBBP
SCHEMBL27519971 0.81 ALOX15 (0.37) EP300HIF1ACREBBP
SCHEMBL28976377 0.81 ALOX15 (0.37) EP300HIF1ACREBBP
SCHEMBL28976380 0.81 ALOX15 (0.37) EP300HIF1ACREBBP
Hydrochloric Acid SCHEMBL29069900 0.80 MAPK1 (0.36) EP300HIF1ACREBBP
SCHEMBL1355956 0.80 EP300 (0.31) EP300HIF1ACREBBP
SCHEMBL7387498 0.79 EP300 (0.30) EP300HIF1ACREBBP
SCHEMBL7389756 0.73 EP300 (0.33) EP300HIF1ACREBBP
SCHEMBL27508457 0.71 EPHX1 (0.33) EP300HIF1ACREBBP
SCHEMBL7168515 0.70 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1261611-A2 INHIBITORS OF HEPATITIS C VIRUS NS3 PROTEASE Bristol-Myers Squibb Pharma Company (US) 2002-12-04 — — EP disclosed
EP-1252178-A1 ALPHA-KETOAMIDE INHIBITORS OF HEPATITIS C VIRUS NS3 PROTEASE Bristol-Myers Squibb Pharma Company (US) 2002-10-30 — — EP disclosed
EP-1196436-A2 PEPTIDE BORONIC ACID INHIBITORS OF HEPATITIS C VIRUS PROTEASE Bristol-Myers Squibb Pharma Company (US) 2002-04-17 — — EP disclosed
WO-2001064678-A2 INHIBITORS OF HEPATITIS C VIRUS NS3 PROTEASE BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-09-07 — — WO disclosed
WO-2001040262-A1 ALPHA-KETOAMIDE INHIBITORS OF HEPATITIS C VIRUS NS3 PROTEASE BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-06-07 — — WO disclosed
WO-2001002424-A2 PEPTIDE BORONIC ACID INHIBITORS OF HEPATITIS C VIRUS PROTEASE DU PONT PHARMACEUTICALS COMPANY (US) 2001-01-11 — — WO disclosed
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