SCHEMBL9626037

SCHEMBL9626037

CCCCCCCCC1CCC(C2CCC(CCC=C(F)F)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
HTT P42858 2/20 0.38
CYP1A2 P05177 3/20 0.36
TP53 P04637 1/20 0.36
LSS P48449 2/20 0.35
PKM P14618 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
EPHX1 P07099 1/20 0.33
MAPT P10636 3/20 0.32
ALDH1A1 P00352 1/20 0.32
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
CCR2 P41597 1/20 0.30
GAA P10253 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
SCHEMBL9626069 1.00 MEN1 (0.38) MEN1KMT2AHTTCYP1A2TP53
SCHEMBL9626450 1.00 MEN1 (0.38) MEN1KMT2AHTTCYP1A2TP53
SCHEMBL9625333 1.00 MEN1 (0.38) MEN1KMT2AHTTCYP1A2TP53
SCHEMBL9625337 1.00 MEN1 (0.38) MEN1KMT2AHTTCYP1A2TP53
SCHEMBL9624986 1.00 MEN1 (0.38) MEN1KMT2AHTTCYP1A2TP53
SCHEMBL9626621 1.00 MEN1 (0.38) MEN1KMT2AHTTCYP1A2TP53
SCHEMBL9626615 1.00 MEN1 (0.38) MEN1KMT2AHTTCYP1A2TP53
SCHEMBL9626454 1.00 MEN1 (0.38) MEN1KMT2AHTTCYP1A2TP53
SCHEMBL9624990 1.00 MEN1 (0.38) MEN1KMT2AHTTCYP1A2TP53
SCHEMBL9625331 1.00 MEN1 (0.38) MEN1KMT2AHTTCYP1A2TP53

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-0325796-B1 A LIQUID CRYSTAL COMPOUND AND A MIXTURE CONTAINING THE SAME Chisso Corporation (JP) 1992-03-11 EP disclosed
US-4877548-A STABLE TO HEAT, LIGHT, ELECTRICITY AND MOISTURE CHISSO CORPORATION (JP) 1989-10-31 US disclosed
EP-0325796-A1 A liquid crystal compound and a mixture containing the same Chisso Corporation (JP) 1989-08-02 EP disclosed