Sugi Predict

Sugi Predict / Compounds / SCHEMBL9683206

SCHEMBL9683206

SCHEMBL9683206

C=CC(=O)OC(=C=O)CN

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 7/20 0.34
▸ ALDH1A1 P00352 5/20 0.34
▸ TP53 P04637 3/20 0.34
▸ HIF1A Q16665 3/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ MAPK1 P28482 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ HPGD P15428 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
SCHEMBL4587745 0.73 — —
Potassium SCHEMBL31261840 0.71 TSHR (0.38) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL9683423 0.69 ALDH1A1 (0.38) TSHRALDH1A1HSD17B10
SCHEMBL5702719 0.68 TSHR (0.40) TSHRALDH1A1TP53HIF1ACYP3A4
Formic Acid SCHEMBL31112103 0.68 TSHR (0.35) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL278164 0.68 — —
SCHEMBL7076062 0.66 TSHR (0.43) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL31635272 0.66 TSHR (0.43) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL5071464 0.66 TSHR (0.43) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL30857469 0.66 TSHR (0.43) TSHRALDH1A1TP53HIF1ACYP3A4

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
EP-0468643-A1 Process for the preparation of acrylates THE BRITISH PETROLEUM COMPANY P.L.C. (GB) 1992-01-29 — — EP disclosed