SCHEMBL12242535

SCHEMBL12242535

C=C(C)C(=O)COc1ccc(C#Cc2ccc(C#Cc3ccc4cc(/C=C/C(=O)OCOC(=O)C(=C)C)ccc4c3)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.35
EGFR P00533 1/20 0.35
ERBB2 P04626 1/20 0.35
FFAR1 O14842 1/20 0.34
ALDH1A1 P00352 3/20 0.34
HPGD P15428 3/20 0.34
TTR P02766 2/20 0.34
DPP4 P27487 1/20 0.34
KDM4E B2RXH2 4/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
GAA P10253 2/20 0.34
MAOB P27338 1/20 0.34
APP P05067 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34

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
SCHEMBL12242510 1.00 FDPS (0.35) FDPSEGFRERBB2FFAR1ALDH1A1
SCHEMBL12242508 0.92 CASP3 (0.38) FFAR1KDM4EMEN1KMT2AGAA
SCHEMBL12242492 0.85 FFAR1 (0.40) FFAR1ALDH1A1HPGDKDM4EMEN1
SCHEMBL13963230 0.84 KMT2A (0.36) EGFRERBB2ALDH1A1HPGDTTR
SCHEMBL12242537 0.82 KMT2A (0.40) KDM4EMEN1KMT2AMAOBMAPT
SCHEMBL13963255 0.82 KMT2A (0.34) EGFRERBB2ALDH1A1HPGDTTR
SCHEMBL13963268 0.81 KMT2A (0.39) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL13963249 0.81 KMT2A (0.34) EGFRERBB2ALDH1A1TTRKDM4E
SCHEMBL12242549 0.79 AKR1C3 (0.34) FFAR1ALDH1A1HPGDKDM4EMEN1
SCHEMBL12242481 0.79 FFAR1 (0.44) FFAR1GAA

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
US-8460576-B2 Liquid crystal composition containing polymerizable compound and liquid crystal display element using the same DIC CORPORATION (JP) 2013-06-11 US disclosed
US-20110253936-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME DIC CORPORATION (JP) 2011-10-20 US disclosed