SCHEMBL28287445

SCHEMBL28287445

C=COC(=O)C(CC)OC(C)=O

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM1 P11229 1/20 0.31
TBXA2R P21731 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
SCHEMBL28837873 0.82 TSHR (0.34) TSHRALDH1A1LMNAHSD17B10TDP1
SCHEMBL10012636 0.81 TSHR (0.31) TSHRTDP1
SCHEMBL10012717 0.78 TSHR (0.42) TSHRALDH1A1TDP1CHRM2CHRM4
SCHEMBL27866553 0.76 ALDH1A1 (0.37) TSHRALDH1A1LMNAHSD17B10TDP1
SCHEMBL7395531 0.75 CA1 (0.41) TSHRALDH1A1LMNAHSD17B10TDP1
SCHEMBL10012705 0.75 TSHR (0.39) TSHRALDH1A1TDP1CHRM2CHRM4
SCHEMBL6685614 0.75 ALDH1A1 (0.50) TSHRALDH1A1LMNAHSD17B10TDP1
Acetic Acid SCHEMBL28071158 0.74 TSHR (0.39) TSHRCHRM2CHRM4CHRM1TBXA2R
SCHEMBL18210999 0.74 TSHR (0.37) TSHRALDH1A1LMNAHSD17B10TDP1
SCHEMBL27480081 0.74 TSHR (0.37) TSHRALDH1A1LMNAHSD17B10TDP1

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-109564797-A Film touch sensor and works including the film touch sensor 东友精细化工有限公司 2019-04-02 CN disclosed