SCHEMBL19439769

SCHEMBL19439769

FC(F)(F)C(C1=CCC(OCC2CO2)C=C1)c1ccc(OCC2CO2)cc1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 3/20 0.40
▸ TSHR P16473 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ HPGD P15428 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ HIF1A Q16665 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ PPARG P37231 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.38
▸ PKM P14618 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ CYP3A4 P08684 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL24245304 0.85 TDP1 (0.42) TP53TSHRALDH1A1MAPTHPGD
SCHEMBL19439764 0.79 ALDH1A1 (0.55) TP53TSHRALDH1A1MAPTHPGD
SCHEMBL13388879 0.76 TDP1 (0.34) TP53TSHRALDH1A1MAPTHPGD
SCHEMBL21670982 0.75 TDP1 (0.33) TP53TSHRALDH1A1MAPTHPGD
SCHEMBL22200965 0.72 ALDH1A1 (0.61) TP53TSHRALDH1A1MAPTHPGD
SCHEMBL2892042 0.71 ALDH1A1 (0.55) TP53TSHRALDH1A1MAPTHPGD
SCHEMBL28627527 0.70 KMT2A (0.48) TP53TSHRALDH1A1MAPTHPGD
SCHEMBL18535777 0.70 ALDH1A1 (0.61) TP53TSHRALDH1A1MAPTHPGD
SCHEMBL7966123 0.67 ALDH1A1 (0.70) TP53TSHRALDH1A1MAPTHPGD
SCHEMBL7966299 0.67 KMT2A (0.60) TP53TSHRALDH1A1MAPTHPGD

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-2017167690-A1 NEGATIVE TYPE PHOTOSENSITIVE COMPOSITION CURABLE AT LOW TEMPERATURE AZ ELECTRONIC MATERIALS (LUXEMBOURG) S.A.R.L. (LU) 2017-10-05 — — WO disclosed
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