SCHEMBL13767916

SCHEMBL13767916

CCOC(=O)C1CCC(C2CCC(C)CC2)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.49
ALDH1A1 P00352 5/20 0.46
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
POLB P06746 1/20 0.43
PPM1B O75688 1/20 0.42
PTPN1 P18031 1/20 0.42
PPP1CC P36873 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL15200245 0.94 MAPT (0.53) MAPTALDH1A1MEN1KMT2APPM1B
SCHEMBL1286694 0.94 MAPT (0.53) MAPTALDH1A1MEN1KMT2APPM1B
SCHEMBL12332811 0.94 MAPT (0.53) MAPTALDH1A1MEN1KMT2APPM1B
SCHEMBL18417194 0.92 MAPT (0.55) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL13044829 0.92 MAPT (0.55) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL24352202 0.87 ALDH1A1 (0.57) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL22990900 0.87 ALDH1A1 (0.57) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL8891623 0.85 MAPT (0.60) MAPTALDH1A1MEN1KMT2APPM1B
SCHEMBL2375356 0.85 MAPT (0.60) MAPTALDH1A1MEN1KMT2APPM1B
SCHEMBL4221 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1724324-B1 Liquid crystalline medium MERCK PATENT GMBH (DE) 2009-07-22 EP disclosed