SCHEMBL7901938

SCHEMBL7901938

C/C=C/[C@H]1CC[C@H](/C=C/CC[C@H]2CC[C@H](CCCCC)CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.36
PKM P14618 1/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
CCR2 P41597 1/20 0.30
LSS P48449 2/20 0.30
EPHX1 P07099 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
SCHEMBL7901948 1.00 CYP1A2 (0.36) CYP1A2PKMHTTLMNAMAPK1
SCHEMBL7915586 1.00 CYP1A2 (0.36) CYP1A2PKMHTTLMNAMAPK1
SCHEMBL7915595 1.00 CYP1A2 (0.36) CYP1A2PKMHTTLMNAMAPK1
SCHEMBL7915592 1.00 CYP1A2 (0.36) CYP1A2PKMHTTLMNAMAPK1
SCHEMBL7915581 1.00 CYP1A2 (0.36) CYP1A2PKMHTTLMNAMAPK1
SCHEMBL7901944 1.00 CYP1A2 (0.36) CYP1A2PKMHTTLMNAMAPK1
SCHEMBL7912320 0.95 CYP1A2 (0.33) CYP1A2PKMHTTLMNAMAPK1
SCHEMBL7909752 0.95 CYP1A2 (0.33) CYP1A2PKMHTTLMNAMAPK1
SCHEMBL7912326 0.95 CYP1A2 (0.33) CYP1A2PKMHTTLMNAMAPK1
SCHEMBL7909761 0.95 CYP1A2 (0.33) CYP1A2PKMHTTLMNAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0750028-B1 Alkenylcyclohexane derivatives, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 2001-04-18 EP disclosed
US-5776367-A Alkenylcyclohexane derivatives, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1998-07-07 US disclosed
EP-0750028-A2 Alkenylcyclohexane derivatives, liquid crystal composition and liquid crystal display element Chisso Corporation (JP) 1996-12-27 EP disclosed