SCHEMBL19257785

SCHEMBL19257785

CCCCC1CCC(C(CC)CCC(C)C)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
CYP1A2 P05177 2/20 0.42
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL28221245 0.82 CYP1A2 (0.41) MAPTCYP1A2LMNAMAPK1HTT
SCHEMBL4745176 0.77 SHBG (0.33) MAPTCYP1A2
SCHEMBL9715906 0.77 CYP1A2 (0.36) MAPTCYP1A2LMNAMAPK1HTT
SCHEMBL9715905 0.77 CYP1A2 (0.36) MAPTCYP1A2LMNAMAPK1HTT
SCHEMBL11848016 0.75 CYP1A2 (0.54) MAPTCYP1A2LMNAMAPK1HTT
SCHEMBL17115909 0.74 CYP1A2 (0.48) MAPTCYP1A2LMNAMAPK1HTT
SCHEMBL9556258 0.74 CYP1A2 (0.48) MAPTCYP1A2LMNAMAPK1HTT
SCHEMBL17681484 0.74 CYP1A2 (0.46) MAPTCYP1A2LMNAMAPK1HTT
SCHEMBL11918169 0.72 CYP1A2 (0.50) MAPTCYP1A2LMNAMAPK1HTT
SCHEMBL5691762 0.72 CYP1A2 (0.74) MAPTCYP1A2LMNAMAPK1HTT

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-2357218-B1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2017-08-16 EP disclosed