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Sugi Predict / Compounds / SCHEMBL17583288

SCHEMBL17583288

SCHEMBL17583288

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

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.39
▸ THRB P10828 1/20 0.38
▸ TSHR P16473 3/20 0.37

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
SCHEMBL1633673 0.92 ALDH1A1 (0.37) ALDH1A1THRBTSHR
SCHEMBL27735450 0.85 ALDH1A1 (0.41) ALDH1A1THRBTSHR
SCHEMBL1494599 0.78 ALDH1A1 (0.42) ALDH1A1THRBTSHR
SCHEMBL10532584 0.78 TSHR (0.50) ALDH1A1TSHR
SCHEMBL2784261 0.78 TSHR (0.50) ALDH1A1TSHR
SCHEMBL28404156 0.77 ALDH1A1 (0.43) ALDH1A1THRBTSHR
SCHEMBL28120123 0.76 ALDH1A1 (0.33) ALDH1A1THRBTSHR
SCHEMBL2181846 0.76 TSHR (0.45) ALDH1A1THRBTSHR
SCHEMBL278099 0.76 ALDH1A1 (0.44) ALDH1A1THRBTSHR
SCHEMBL1494476 0.76 ALDH1A1 (0.44) ALDH1A1THRBTSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3001228-A1 NEAR-INFRARED-ABSORBING COMPOSITION, NEAR-INFRARED CUT-OFF FILTER AND PRODUCTION METHOD USING SAME, AND CAMERA MODULE Fujifilm Corporation (JP) 2016-03-30 — — EP disclosed
US-20160077256-A1 NEAR-INFRARED-ABSORBING COMPOSITION, NEAR-INFRARED CUT-OFF FILTER AND PRODUCTION METHOD USING SAME, AND CAMERA MODULE FUJIFILM CORPORATION (JP) 2016-03-17 — — US disclosed