SCHEMBL31364542

SCHEMBL31364542

C=C(C)C(=O)OC(F)(F)OC(=O)C(=C)C

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
TSHR P16473 3/20 0.38
THRB P10828 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL10899304 0.84 ALDH1A1 (0.48) ALDH1A1TSHRTHRBTDP1HSD17B10
SCHEMBL268102 0.84 ALDH1A1 (0.48) ALDH1A1TSHRTHRBTDP1HSD17B10
Methane SCHEMBL28151800 0.82 ALDH1A1 (0.46) ALDH1A1TSHRTHRBTDP1HSD17B10
SCHEMBL145853 0.82 ALDH1A1 (0.46) ALDH1A1TSHRTHRBTDP1HSD17B10
SCHEMBL3134330 0.82 ALDH1A1 (0.46) ALDH1A1TSHRTHRBTDP1HSD17B10
SCHEMBL771313 0.80 ALDH1A1 (0.44) ALDH1A1TSHRTHRBTDP1
SCHEMBL143424 0.80 ALDH1A1 (0.44) ALDH1A1TSHRTHRBTDP1
SCHEMBL771097 0.80 ALDH1A1 (0.44) ALDH1A1TSHRTHRBTDP1
SCHEMBL31364544 0.80 ALDH1A1 (0.44) ALDH1A1TSHRTHRBTDP1
SCHEMBL18789073 0.78 ALDH1A1 (0.42) ALDH1A1TSHRTHRBTDP1

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
WO-2025022004-A2 OPHTHALMIC LENS CONTAMAC LIMITED (GB) 2025-01-30 WO disclosed