SCHEMBL28407841

SCHEMBL28407841

C=CC(=O)OCCCCCC[SiH2]c1cccc(OCC)c1OCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ HPGD P15428 2/20 0.40
▸ THRB P10828 2/20 0.38
▸ THRA P10827 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ L3MBTL1 Q9Y468 3/20 0.34
▸ LMNA P02545 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ HCRTR1 O43613 2/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ NR1I2 O75469 1/20 0.33
▸ CHRM2 P08172 1/20 0.33
▸ ADRA2A P08913 1/20 0.33
▸ OPRK1 P41145 1/20 0.33

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
SCHEMBL28407981 1.00 TSHR (0.42) TSHRALDH1A1CYP3A4HPGDTHRB
SCHEMBL28407979 0.99 TSHR (0.40) TSHRALDH1A1CYP3A4HPGDTHRB
SCHEMBL28405465 0.95 TSHR (0.41) TSHRALDH1A1CYP3A4HPGDTHRB
SCHEMBL28407922 0.84 TSHR (0.44) TSHRALDH1A1CYP3A4HPGDTHRB
SCHEMBL28404111 0.84 TSHR (0.44) TSHRALDH1A1CYP3A4HPGDTHRB
SCHEMBL28403928 0.84 ALDH1A1 (0.44) TSHRALDH1A1CYP3A4HPGDTHRB
SCHEMBL28412639 0.84 ALDH1A1 (0.44) TSHRALDH1A1CYP3A4HPGDTHRB
SCHEMBL28407848 0.83 POLB (0.42) TSHRALDH1A1HPGDTHRBKDM4E
SCHEMBL28403972 0.83 ALDH1A1 (0.42) TSHRALDH1A1CYP3A4HPGDTHRB
SCHEMBL707985 0.80 ALDH1A1 (0.39) TSHRALDH1A1KDM4EL3MBTL1LMNA

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-109964327-B Field-effect transistor, method for manufacturing same, wireless communication device using same, and commodity label 东丽株式会社 2020-05-19 — — CN disclosed
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