SCHEMBL2268783

SCHEMBL2268783

CC1(C)CCC(=O)OC1(C)C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.32
LMNA P02545 3/20 0.31
TSHR P16473 1/20 0.31
CYP2C9 P11712 1/20 0.31
POLB P06746 1/20 0.31

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
SCHEMBL92282 0.74
SCHEMBL439923 0.74 LMNA (0.33) LMNACYP2C9
SCHEMBL14508121 0.71 ALDH1A1 (0.31)
SCHEMBL166075 0.70
SCHEMBL13129929 0.70
SCHEMBL12259718 0.70
SCHEMBL19027583 0.70
SCHEMBL13156976 0.70
SCHEMBL9607567 0.68 TSHR (0.32) LMNATSHRCYP2C9POLB
SCHEMBL8070468 0.68 LMNA (0.32) LMNATSHRCYP2C9

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-2515657-A1 TYROSINE KINASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-10-31 EP disclosed
WO-2011084402-A1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-07-14 WO disclosed