SCHEMBL11080655

SCHEMBL11080655

CCOC(=O)C1(CCCC2CCCCCC2)CO1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
ABCB11 O95342 1/20 0.46
LMNA P02545 1/20 0.46
MAPK1 P28482 1/20 0.46
CYP1A2 P05177 1/20 0.40
NAAA Q02083 3/20 0.38
EPHX1 P07099 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
MMP2 P08253 1/20 0.36
BMP1 P13497 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ATM Q13315 1/20 0.36
METAP2 P50579 1/20 0.36
FKBP1A P62942 1/20 0.36

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
SCHEMBL11075060 1.00 MAPT (0.46) MAPTABCB11LMNAMAPK1CYP1A2
SCHEMBL11076786 1.00 MAPT (0.46) MAPTABCB11LMNAMAPK1CYP1A2
SCHEMBL11067568 1.00 MAPT (0.46) MAPTABCB11LMNAMAPK1CYP1A2
SCHEMBL11070127 1.00 MAPT (0.46) MAPTABCB11LMNAMAPK1CYP1A2
SCHEMBL11077258 0.99 MAPT (0.47) MAPTABCB11LMNAMAPK1CYP1A2
SCHEMBL11069904 0.96 ABCB11 (0.48) MAPTABCB11LMNAMAPK1CYP1A2
SCHEMBL11075276 0.94 ABCB11 (0.50) MAPTABCB11LMNAMAPK1CYP1A2
SCHEMBL11080379 0.94 ABCB11 (0.50) MAPTABCB11LMNAMAPK1CYP1A2
SCHEMBL11021372 0.94 ABCB11 (0.50) MAPTABCB11LMNAMAPK1CYP1A2
SCHEMBL11073851 0.94 ABCB11 (0.50) MAPTABCB11LMNAMAPK1CYP1A2

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
US-4430339-A PROPHYLAXIS, METABOLISM, GLUCOSE, FATS, HYPOGLYCEMIC AGENTS BYK GULDEN LOMBERG CHEMISCHE FABRIK GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1984-02-07 US disclosed
WO-1982000822-A1 SUBSTITUTED OXIRANECARBOXYLIC ACIDS,THEIR PREPARATION AND THEIR USE AS MEDICAMENTS EISTETTER K 1982-03-18 WO disclosed