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SCHEMBL16206249

SCHEMBL16206249

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

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.37
▸ TP53 P04637 3/20 0.37
▸ HIF1A Q16665 3/20 0.37
▸ CYP3A4 P08684 2/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ TSHR P16473 5/20 0.32
▸ HSD17B10 Q99714 1/20 0.30
▸ THRB P10828 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
SCHEMBL16206262 0.92 ALDH1A1 (0.36) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL16206257 0.92 ALDH1A1 (0.36) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL16206248 0.92 ALDH1A1 (0.36) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL16206255 0.88 ALDH1A1 (0.38) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL16206261 0.80 — —
SCHEMBL16206254 0.80 TSHR (0.34) TSHR
SCHEMBL16326511 0.79 ALDH1A1 (0.46) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL14828647 0.79 ALDH1A1 (0.46) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL16326509 0.78 ALDH1A1 (0.44) ALDH1A1TP53HIF1ACYP3A4MAPK1
SCHEMBL13096928 0.78 ALDH1A1 (0.44) ALDH1A1TP53HIF1ACYP3A4MAPK1

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
US-20140320948-A1 OPTICAL ELEMENT AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2014-10-30 — — US disclosed