SCHEMBL7065829

SCHEMBL7065829

CCCCCC1CCC(C(=O)O)(c2cc(F)c(C#N)c(F)c2)CC1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
APP P05067 5/20 0.34
CYP2C9 P11712 4/20 0.34
CYP3A4 P08684 3/20 0.34
CYP2C19 P33261 3/20 0.34
CYP2D6 P10635 2/20 0.34
CHRM2 P08172 2/20 0.33
CHRM1 P11229 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33
AKR1C3 P42330 4/20 0.33
AKR1C2 P52895 4/20 0.33
AKR1C1 Q04828 3/20 0.33
AKR1B10 O60218 1/20 0.33
AKR1C4 P17516 1/20 0.33
TSHR P16473 1/20 0.33
CHRM5 P08912 1/20 0.33
FASN P49327 1/20 0.32

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
SCHEMBL6319721 0.92 APP (0.35) MEN1KMT2AAPPCYP2C9CYP3A4
SCHEMBL9763553 0.87 MEN1 (0.39) MEN1KMT2AAPPCYP2C9CYP3A4
SCHEMBL9763952 0.86 MEN1 (0.38) MEN1KMT2AAPPCYP2C9CYP3A4
SCHEMBL9763536 0.86 MEN1 (0.38) MEN1KMT2AAPPCYP2C9CYP3A4
SCHEMBL9764010 0.86 MEN1 (0.38) MEN1KMT2AAPPCYP2C9CYP3A4
SCHEMBL9763963 0.86 MEN1 (0.38) MEN1KMT2AAPPCYP2C9CYP3A4
SCHEMBL9763541 0.86 MEN1 (0.38) MEN1KMT2AAPPCYP2C9CYP3A4
SCHEMBL7066508 0.86 APP (0.39) MEN1KMT2AAPPCYP2C9CYP3A4
SCHEMBL9764343 0.85 MEN1 (0.37) MEN1KMT2AAPPCYP2C9CYP3A4
SCHEMBL9763595 0.84 MEN1 (0.36) MEN1KMT2AAPPCYP2C9CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0673986-B1 Active matrix type liquid crystal display apparatus HITACHI LTD (JP) 2003-06-04 EP disclosed
EP-1070753-A2 Liquid crystal compounds and their use in active matrix type liquid crystal display devices HITACHI, LTD. (JP) 2001-01-24 EP disclosed