SCHEMBL20152476

SCHEMBL20152476

CC1CCC(OC(=O)C2CCC(C(=O)OC3CCC(C)CC3)CC2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.41
MAPT P10636 3/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
EPHX1 P07099 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HCRTR2 O43614 1/20 0.32
FABP7 O15540 1/20 0.31
FABP5 Q01469 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SERPINE1 P05121 1/20 0.31
POLB P06746 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
SCHEMBL20152479 1.00 CYP19A1 (0.41) CYP19A1MAPTRAB9ANPC1ALDH1A1
SCHEMBL12377040 1.00 CYP19A1 (0.41) CYP19A1MAPTRAB9ANPC1ALDH1A1
SCHEMBL20275995 1.00 CYP19A1 (0.41) CYP19A1MAPTRAB9ANPC1ALDH1A1
SCHEMBL20276012 1.00 CYP19A1 (0.41) CYP19A1MAPTRAB9ANPC1ALDH1A1
SCHEMBL20152474 1.00 CYP19A1 (0.41) CYP19A1MAPTRAB9ANPC1ALDH1A1
SCHEMBL170528 0.94 CYP19A1 (0.38) CYP19A1MAPTRAB9ANPC1ALDH1A1
SCHEMBL14274401 0.94 CYP19A1 (0.38) CYP19A1MAPTRAB9ANPC1ALDH1A1
SCHEMBL20152489 0.94 CYP19A1 (0.38) CYP19A1MAPTRAB9ANPC1ALDH1A1
SCHEMBL14465468 0.94 CYP19A1 (0.38) CYP19A1MAPTRAB9ANPC1ALDH1A1
SCHEMBL13074339 0.94 CYP19A1 (0.38) CYP19A1MAPTRAB9ANPC1ALDH1A1

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
US-20180171229-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE DIC CORPORATION (JP) 2018-06-21 US disclosed
US-20180171234-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME DIC CORPORATION (JP) 2018-06-21 US disclosed
US-20180134961-A1 LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE USING THE SAME DIC CORPORATION (JP) 2018-05-17 US disclosed