SCHEMBL29214526

SCHEMBL29214526

CCc1c(C)c(F)c(F)c(-c2ccccc2)c1C1CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ PSMB8 P28062 1/20 0.34
▸ PSMB5 P28074 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ MAT2A P31153 3/20 0.33
▸ ABCB1 P08183 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ CASP3 P42574 1/20 0.31
▸ SENP7 Q9BQF6 1/20 0.31
▸ SENP6 Q9GZR1 1/20 0.31
▸ NPY5R Q15761 1/20 0.31
▸ ADORA3 P0DMS8 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ ESR1 P03372 1/20 0.31

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
SCHEMBL31186270 0.82 ADORA3 (0.33) MEN1MAPTRAB9AKMT2ANPSR1
SCHEMBL31403438 0.82 MEN1 (0.34) MEN1MAPTRAB9AKMT2ANPSR1
Phosphine SCHEMBL5609398 0.81 MEN1 (0.36) MEN1MAPTRAB9AKMT2ANPSR1
SCHEMBL28435916 0.80 ABCB1 (0.37) MEN1MAPTRAB9AKMT2ANPSR1
SCHEMBL28435918 0.80 ABCB1 (0.37) MEN1MAPTRAB9AKMT2ANPSR1
SCHEMBL30450532 0.75 GABRA1 (0.33) NPSR1HPGD
SCHEMBL29016457 0.74 ALDH1A1 (0.33) MEN1MAPTRAB9AKMT2ANPSR1
SCHEMBL31403442 0.74 DRD2 (0.35) MEN1MAPTRAB9AKMT2ANPSR1
SCHEMBL30352766 0.70 ALDH1A1 (0.32) NPSR1HPGDMAT2AL3MBTL1
SCHEMBL12835285 0.69 ESR1 (0.42) MAPTRAB9ANPSR1HPGDKDM4E

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
CN-118063671-A Liquid crystal/polymer composite material, preparation method thereof, dimming film containing liquid crystal/polymer composite material and application of dimming film 北京大学 2024-05-24 — — CN disclosed
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