SCHEMBL28294422

SCHEMBL28294422

C=CC(=O)OC(CCCC)n1c(=O)[nH]c(=O)[nH]c1=O

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
HPGD P15428 1/20 0.37
THRB P10828 3/20 0.33
HTT P42858 3/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
THRA P10827 1/20 0.31
CTSK P43235 2/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL28004596 0.96 TSHR (0.37) TSHRHPGDTHRBHTTSMN1; SMN2
SCHEMBL28004997 0.92 TSHR (0.33) TSHRHPGDTHRB
SCHEMBL28004952 0.86 TSHR (0.32) TSHRHPGD
SCHEMBL16694128 0.84 TSHR (0.45) TSHRHPGDTHRBSMN1; SMN2THRA
SCHEMBL28294389 0.81 TSHR (0.36) TSHRALDH1A1
SCHEMBL16694110 0.80 TSHR (0.41) TSHRHPGDTHRBSMN1; SMN2THRA
SCHEMBL28294395 0.77 TSHR (0.38) TSHRALDH1A1
SCHEMBL21808345 0.75 TSHR (0.34) TSHR
SCHEMBL16694104 0.75 TSHR (0.37) TSHRHPGDTHRBSMN1; SMN2THRA
SCHEMBL28004961 0.72 TSHR (0.33) TSHRALDH1A1

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-104428713-B Photosensitive polymer combination, conductive wires protective film and touch panel component 东丽株式会社 2019-06-07 CN disclosed