SCHEMBL6572234

SCHEMBL6572234

CCCCCC1(C(=O)OCC)CC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.46
CYP4A11 Q02928 1/20 0.46
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
POLB P06746 1/20 0.41
PKM P14618 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPK1 P28482 1/20 0.40
NPY1R P25929 1/20 0.39

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
SCHEMBL3492496 0.98 CYP4F2 (0.49) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL798044 0.92 CYP4F2 (0.53) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL11345271 0.87 CYP4F2 (0.49) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL8071102 0.87 CYP4F2 (0.45) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL16639041 0.87 LMNA (0.42) MEN1KMT2APOLBPKMLMNA
SCHEMBL882521 0.85 CYP4F2 (0.47) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL798228 0.85 CYP4F2 (0.47) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL798312 0.85 CYP4F2 (0.47) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL798479 0.85 CYP4F2 (0.47) CYP4F2CYP4A11MEN1KMT2APOLB
SCHEMBL798058 0.85 CYP4F2 (0.47) CYP4F2CYP4A11MEN1KMT2APOLB

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
EP-1455809-A2 INHIBITORS OF HEPATITIS C VIRUS Bristol-Myers Squibb Company (US) 2004-09-15 EP disclosed
WO-2003053349-A2 INHIBITORS OF HEPATITIS C VIRUS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-07-03 WO disclosed