SCHEMBL27901751

SCHEMBL27901751

CCCCCC([CH]c1ccccc1)CCC

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
CSNK1E P49674 1/20 0.38
CNR2 P34972 1/20 0.37
LTA4H P09960 2/20 0.37
EGFR P00533 1/20 0.36
CNR1 P21554 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HDAC3 O15379 1/20 0.33

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
SCHEMBL6597173 0.94 LMNA (0.38) LMNATDP1CNR2LTA4HEGFR
SCHEMBL11410075 0.83 TSHR (0.45) LMNATDP1CNR2LTA4HEGFR
SCHEMBL27293430 0.82 LMNA (0.34) LMNAMEN1KMT2A
SCHEMBL4299524 0.82 EGFR (0.41) LMNATDP1CSNK1ECNR2EGFR
SCHEMBL10703015 0.81 EGFR (0.43) LMNATDP1CSNK1EEGFRCNR1
SCHEMBL236417 0.81 EGFR (0.43) LMNATDP1CSNK1EEGFRCNR1
SCHEMBL4612716 0.81 EGFR (0.43) LMNATDP1CSNK1EEGFRCNR1
SCHEMBL27460410 0.79 LMNA (0.41) LMNATDP1CSNK1ECNR2EGFR
Ethylene Glycol SCHEMBL4570274 0.77 EGFR (0.40) LMNATDP1CSNK1ECNR2EGFR
SCHEMBL10497060 0.76 TDP1 (0.49) LMNATDP1CSNK1EEGFRALDH1A1

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
CN-101970550-B Polymer carbon nanotube composites NANOLEDGE INC 2012-12-26 CN disclosed