SCHEMBL16613180

SCHEMBL16613180

C=CCNC(=O)C(=C)C(O)O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 4/20 0.37
FAAH O00519 1/20 0.36
RAB9A P51151 2/20 0.36
KDM4E B2RXH2 1/20 0.35
HPGD P15428 3/20 0.34
ATM Q13315 1/20 0.34
LMNA P02545 2/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL1539137 0.81 TSHR (0.42) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL4952777 0.78 TSHR (0.56) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL17700983 0.77 SMN1; SMN2 (0.36) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL30285305 0.75 TSHR (0.41) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL17063636 0.75 FAAH (0.39) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL29424 0.75
SCHEMBL27958358 0.75
SCHEMBL30604 0.73
SCHEMBL28386814 0.73 TSHR (0.46) TSHRSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL5708695 0.73

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
EP-1719784-B1 Alcohol compatible copolymer AKZO NOBEL NV (NL) 2015-04-08 EP claimed