SCHEMBL14765801

SCHEMBL14765801

CCOc1ccc(-c2ccc(C3CCC(c4ccc(OCC)c(F)c4)CC3)c(F)c2F)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.44
FPR2 P25090 6/20 0.39
FFAR1 O14842 5/20 0.37
PPARD Q03181 3/20 0.37
FFAR4 Q5NUL3 3/20 0.36
DHODH Q02127 1/20 0.35
NAAA Q02083 1/20 0.35
CAMKK1 Q8N5S9 1/20 0.33
CAMKK2 Q96RR4 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
SCHEMBL12716238 0.94 KDM1A (0.43) KDM1AFPR2
SCHEMBL12733924 0.91 KDM1A (0.44) KDM1AFPR2NAAACAMKK1CAMKK2
SCHEMBL14765838 0.91 KDM1A (0.37) KDM1AFPR2FFAR1PPARDFFAR4
SCHEMBL12733916 0.90 KDM1A (0.44) KDM1AFPR2FFAR4NAAACAMKK1
SCHEMBL14765662 0.90 KDM1A (0.36) KDM1AFPR2FFAR1PPARDFFAR4
SCHEMBL12733923 0.89 KDM1A (0.43) KDM1AFPR2FFAR4NAAACAMKK1
SCHEMBL14765685 0.89 FPR2 (0.36) KDM1AFPR2FFAR1FFAR4
SCHEMBL14765817 0.89 FPR2 (0.37) FPR2FFAR1FFAR4
SCHEMBL12733917 0.89 KDM1A (0.42) KDM1AFPR2FFAR4NAAACAMKK1
SCHEMBL14765837 0.88 FPR2 (0.39) KDM1AFPR2FFAR1PPARDFFAR4

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
US-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed