SCHEMBL19985491

SCHEMBL19985491

CCCCOc1ccc(-c2ccc(C3CCC(CCCC)CC3)c(F)c2F)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ CYP1A2 P05177 2/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ SCN9A Q15858 1/20 0.35
▸ ALOX5AP P20292 3/20 0.33
▸ FEN1 P39748 3/20 0.33
▸ FPR2 P25090 2/20 0.33
▸ PPARG P37231 1/20 0.33
▸ PTGES O14684 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
SCHEMBL19985494 0.96 GAA (0.35) GAAMEN1MAPK1KMT2AMAPT
SCHEMBL19985486 0.96 FPR2 (0.36) GAAMEN1MAPK1KMT2AMAPT
SCHEMBL19985498 0.96 GAA (0.35) GAAMEN1MAPK1KMT2AMAPT
SCHEMBL14922542 0.96 SCN9A (0.36) GAAMEN1MAPK1KMT2AMAPT
SCHEMBL19985487 0.95 GAA (0.35) GAAMEN1MAPK1KMT2AMAPT
SCHEMBL19985503 0.95 GAA (0.37) GAAMEN1MAPK1KMT2AMAPT
SCHEMBL19985493 0.95 GAA (0.35) GAAMEN1MAPK1KMT2AMAPT
SCHEMBL19985510 0.95 GAA (0.37) GAAMEN1MAPK1KMT2AMAPT
SCHEMBL19985489 0.95 GAA (0.35) GAAMEN1MAPK1KMT2AMAPT
SCHEMBL19985488 0.95 GAA (0.35) GAAMEN1MAPK1KMT2AMAPT

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-20180079959-A1 LIQUID CRYSTAL ELEMENT WITH NEGATIVE DIELECTRIC ANISOTROPY DIC CORPORATION (JP) 2018-03-22 — — US disclosed
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