SCHEMBL9408320

SCHEMBL9408320

CCCC[C@H]1CC[C@H]([C@H]2CC[C@H](C=CCCC(=O)O)CC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.49
EPHX2 P34913 1/20 0.38
PPARG P37231 5/20 0.37
PPARD Q03181 4/20 0.37
PPARA Q07869 4/20 0.37
TERT O14746 3/20 0.37
PTPN1 P18031 3/20 0.37
BLM P54132 3/20 0.37
HSD17B10 Q99714 3/20 0.37
FABP4 P15090 3/20 0.37
TOP1 P11387 3/20 0.37
F7 P08709 2/20 0.37
F3 P13726 2/20 0.37
USP2 O75604 2/20 0.37
LMNA P02545 2/20 0.37
ALOX15 P16050 2/20 0.37
RECQL P46063 2/20 0.37
CYP19A1 P11511 2/20 0.37
TBXA2R P21731 2/20 0.37
NR4A2 P43354 2/20 0.37

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
SCHEMBL9408479 0.96 MAPT (0.45) MAPTEPHX2PPARGPPARDPPARA
SCHEMBL9408452 0.92 MAPT (0.38) MAPTEPHX2PPARGPPARDPPARA
SCHEMBL9408234 0.86 MAPT (0.44) MAPTLMNAALOX15KMT2ACYP1A2
SCHEMBL9408308 0.85 MAPT (0.40) MAPTEPHX2PPARGPPARDPPARA
SCHEMBL9408395 0.82 MAPT (0.40) MAPTBLMHSD17B10USP2LMNA
SCHEMBL10954710 0.80 MAPT (0.61) MAPTPPARGPPARDPPARAPTPN1
SCHEMBL10844764 0.80 MAPT (0.61) MAPTPPARGPPARDPPARAPTPN1
SCHEMBL10954713 0.80 MAPT (0.61) MAPTPPARGPPARDPPARAPTPN1
SCHEMBL10954545 0.80 MAPT (0.61) MAPTPPARGPPARDPPARAPTPN1
SCHEMBL10954550 0.80 MAPT (0.61) MAPTPPARGPPARDPPARAPTPN1

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-0595144-A1 Cyclohexyl alkenoates as components of liquid crystalline mixtures F. HOFFMANN-LA ROCHE AG (CH) 1994-05-04 EP disclosed