SCHEMBL7153121

SCHEMBL7153121

CCCCCC1CCC(C(C)C2CCC(CCC)CC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.43
TP53 P04637 1/20 0.41
MAPT P10636 3/20 0.40
PKM P14618 1/20 0.37
HTT P42858 2/20 0.37
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
EPHX1 P07099 1/20 0.35
LSS P48449 2/20 0.34
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
CCR2 P41597 1/20 0.31
GAA P10253 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
SCHEMBL10479765 1.00 CYP1A2 (0.43) CYP1A2TP53MAPTPKMHTT
SCHEMBL10718899 0.87 CYP1A2 (0.44) CYP1A2TP53MAPTPKMHTT
SCHEMBL10347388 0.87 CYP1A2 (0.39) CYP1A2TP53MAPTPKMHTT
SCHEMBL9767608 0.84 CYP1A2 (0.37) CYP1A2TP53MAPTPKMHTT
SCHEMBL28222077 0.83 CYP1A2 (0.46) CYP1A2TP53MAPTPKMHTT
SCHEMBL9337236 0.83 CYP1A2 (0.41) CYP1A2TP53MAPTPKMHTT
SCHEMBL10479556 0.83 CYP1A2 (0.36) CYP1A2TP53MAPTPKMHTT
SCHEMBL10479761 0.83 CYP1A2 (0.54) CYP1A2TP53MAPTPKMHTT
SCHEMBL10479756 0.83 CYP1A2 (0.54) CYP1A2TP53MAPTPKMHTT
SCHEMBL4802485 0.83 CYP1A2 (0.54) CYP1A2TP53MAPTPKMHTT

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
US-6562419-B1 Matrix liquid crystal display MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2003-05-13 US disclosed