SCHEMBL19985498

SCHEMBL19985498

CCCCCC1CCC(c2ccc(-c3ccc(OCCCC)c(F)c3F)c(F)c2F)CC1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ SCN9A Q15858 1/20 0.35
▸ FPR2 P25090 2/20 0.33
▸ ALOX5AP P20292 3/20 0.33
▸ FEN1 P39748 3/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ PPARG P37231 1/20 0.32
▸ 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
SCHEMBL19985503 0.99 GAA (0.37) GAAMAPTSCN9AFPR2ALOX5AP
SCHEMBL19985523 0.99 GAA (0.37) GAAMAPTSCN9AFPR2ALOX5AP
SCHEMBL19985510 0.99 GAA (0.37) GAAMAPTSCN9AFPR2ALOX5AP
SCHEMBL19985490 0.98 GAA (0.35) GAAMAPTSCN9AFPR2ALOX5AP
SCHEMBL19985515 0.96 GAA (0.37) GAAMAPTSCN9AFPR2ALOX5AP
SCHEMBL19985496 0.96 FPR2 (0.36) GAAMAPTSCN9AFPR2ALOX5AP
SCHEMBL19985499 0.96 GAA (0.37) GAAMAPTSCN9AFPR2ALOX5AP
SCHEMBL19985508 0.96 GAA (0.37) GAAMAPTSCN9AFPR2ALOX5AP
SCHEMBL19985525 0.96 GAA (0.37) GAAMAPTSCN9AFPR2ALOX5AP
SCHEMBL19985506 0.96 GAA (0.37) GAAMAPTSCN9AFPR2ALOX5AP

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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