SCHEMBL28403972

SCHEMBL28403972

C=CC(=O)OCCCC[SiH2]c1cccc(OC)c1OC

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.42
▸ TSHR P16473 2/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ HPGD P15428 4/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ NFE2L2 Q16236 2/20 0.38
▸ THRB P10828 2/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ LMNA P02545 2/20 0.36
▸ THRA P10827 1/20 0.35
▸ POLB P06746 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ AKR1B10 O60218 1/20 0.34
▸ AKR1B1 P15121 1/20 0.34

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
SCHEMBL28412639 0.99 ALDH1A1 (0.44) ALDH1A1TSHRCYP3A4HPGDKDM4E
SCHEMBL28403928 0.99 ALDH1A1 (0.44) ALDH1A1TSHRCYP3A4HPGDKDM4E
SCHEMBL28399390 0.96 HPGD (0.40) ALDH1A1TSHRCYP3A4HPGDKDM4E
SCHEMBL28407979 0.84 TSHR (0.40) ALDH1A1TSHRCYP3A4HPGDKDM4E
SCHEMBL28407920 0.83 POLB (0.41) ALDH1A1TSHRHPGDNFE2L2THRB
SCHEMBL28407841 0.83 TSHR (0.42) ALDH1A1TSHRCYP3A4HPGDKDM4E
SCHEMBL28407981 0.83 TSHR (0.42) ALDH1A1TSHRCYP3A4HPGDKDM4E
SCHEMBL28407867 0.82 TSHR (0.43) ALDH1A1TSHRCYP3A4HPGDNFE2L2
SCHEMBL28401961 0.82 TSHR (0.43) ALDH1A1TSHRCYP3A4HPGDNFE2L2
SCHEMBL15910762 0.82 SMN1; SMN2 (0.57) ALDH1A1TSHRCYP3A4HPGDKDM4E

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
Send feedback