SCHEMBL17266372

SCHEMBL17266372

C=C(C)C(=C)NCCc1ccc(O)c(O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.66
▸ ALDH1A1 P00352 5/20 0.66
▸ HSD17B10 Q99714 3/20 0.66
▸ KDM4E B2RXH2 3/20 0.66
▸ HIF1A Q16665 2/20 0.66
▸ LMNA P02545 2/20 0.66
▸ HPGD P15428 2/20 0.66
▸ BLM P54132 2/20 0.66
▸ PTGS1 P23219 1/20 0.66
▸ MAPK1 P28482 2/20 0.59
▸ ALOX15 P16050 2/20 0.59
▸ TP53 P04637 1/20 0.59
▸ CYP1A2 P05177 1/20 0.59
▸ TSHR P16473 1/20 0.59
▸ NFKB1 P19838 1/20 0.59
▸ THPO P40225 1/20 0.59
▸ GMNN O75496 1/20 0.57
▸ GFER P55789 1/20 0.57
▸ PMP22 Q01453 1/20 0.57
▸ SMN1; SMN2 Q16637 1/20 0.57

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
SCHEMBL12305065 0.86 MAPT (0.70) MAPTALDH1A1HSD17B10KDM4EHIF1A
SCHEMBL400288 0.85 MAPT (0.73) MAPTALDH1A1HSD17B10KDM4EHIF1A
SCHEMBL30446328 0.85 MAPT (0.73) MAPTALDH1A1HSD17B10KDM4EHIF1A
SCHEMBL17266371 0.83 MTNR1A (0.59) MAPTLMNAMAPK1TSHRKMT2A
SCHEMBL17266373 0.81 KDM4E (0.62) MAPTKDM4EHIF1ALMNACYP1A2
SCHEMBL328568 0.79 MAPT (1.00) MAPTALDH1A1HSD17B10KDM4EHIF1A
SCHEMBL30616852 0.79 MAPT (1.00) MAPTALDH1A1HSD17B10KDM4EHIF1A
SCHEMBL29870429 0.78 MAPT (0.97) MAPTALDH1A1HSD17B10KDM4EHIF1A
Bromide SCHEMBL28839154 0.78 MAPT (0.97) MAPTALDH1A1HSD17B10KDM4EHIF1A
Water SCHEMBL1321161 0.78 MAPT (0.97) MAPTALDH1A1HSD17B10KDM4EHIF1A

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-2015175665-A1 BIOADHESIVE COMPOUNDS AND METHODS OF SYNTHESIS AND USE DSM IP ASSETS B.V. (NL) 2015-11-19 — — WO disclosed
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