SCHEMBL9962893

SCHEMBL9962893

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

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.56
ALDH1A1 P00352 4/20 0.56
KDM4E B2RXH2 3/20 0.56
HSD17B10 Q99714 3/20 0.56
LMNA P02545 3/20 0.56
HIF1A Q16665 2/20 0.56
HPGD P15428 2/20 0.56
BLM P54132 2/20 0.56
PTGS1 P23219 1/20 0.56
ALPL P05186 1/20 0.49
F13A1 P00488 1/20 0.45
POLB P06746 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
TRPV1 Q8NER1 1/20 0.44
PTGS2 P35354 1/20 0.43
JAK3 P52333 1/20 0.43
MAPK1 P28482 2/20 0.43
GAA P10253 1/20 0.43
PKM P14618 1/20 0.43

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
SCHEMBL30446328 0.88 MAPT (0.73) MAPTALDH1A1KDM4EHSD17B10LMNA
SCHEMBL400288 0.88 MAPT (0.73) MAPTALDH1A1KDM4EHSD17B10LMNA
SCHEMBL16281785 0.86 MAPT (0.76) MAPTALDH1A1KDM4EHSD17B10LMNA
SCHEMBL20746326 0.81 KDM4E (0.50) MAPTALDH1A1KDM4EHSD17B10LMNA
SCHEMBL17041929 0.80 PTGS1 (0.41) MAPTALDH1A1KDM4EHSD17B10LMNA
SCHEMBL105520 0.79 KDM4E (0.71) MAPTALDH1A1KDM4EHSD17B10LMNA
SCHEMBL19366780 0.78 MTNR1A (0.65) ALDH1A1LMNAMAPK1TSHR
Protocatechualdehyde SCHEMBL23610641 0.78 MAPT (0.59) MAPTALDH1A1KDM4EHSD17B10LMNA
SCHEMBL22212822 0.77 MAPT (0.49) MAPTALDH1A1KDM4EHSD17B10LMNA
SCHEMBL11899577 0.77 ALDH1A1 (0.45) MAPTALDH1A1KDM4EHSD17B10LMNA

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202956-B2 Copolymers having zwitterionic moieties and dihydroxyphenyl moieties and medical devices coated with the copolymers ABBOTT LABORATORIES (US) 2012-06-19 US disclosed
US-20110160382-A1 COPOLYMERS HAVING ZWITTERIONIC MOIETIES AND DIHDROXYPHENYL MOIETIES AND MEDICAL DEVICES COATED WITH THE COPOLYMERS ABBOTT LABORATORIES (US) 2011-06-30 US disclosed