SCHEMBL9565749

SCHEMBL9565749

CCO/C(CC)=C(\C(=O)O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
MAPT P10636 3/20 0.47
NPC1 O15118 2/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.44
CES2 O00748 1/20 0.44
CES1 P23141 1/20 0.44
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.43
GAA P10253 3/20 0.43
RAB9A P51151 1/20 0.43
PIN1 Q13526 1/20 0.41
POLB P06746 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL1145279 0.82 ELANE (0.51) KMT2AMAPTNPC1ALDH1A1LMNA
SCHEMBL6204948 0.82 ELANE (0.51) KMT2AMAPTNPC1ALDH1A1LMNA
SCHEMBL18812997 0.81 MEN1 (0.50) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL11808595 0.79 MEN1 (0.48) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL11808597 0.79 MEN1 (0.48) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL11312418 0.78 CES2 (0.41) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL11857829 0.77 ALDH1A1 (0.62) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL9359710 0.76 MEN1 (0.46) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL18578748 0.76 ALDH1A1 (0.45) MEN1KMT2AMAPTNPC1ALDH1A1
SCHEMBL9359702 0.76 MEN1 (0.46) MEN1KMT2AMAPTNPC1ALDH1A1

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-0572900-A2 Coating and its use in a process for preparing multilayer coatings Herberts Gesellschaft mit beschränkter Haftung (DE) 1993-12-08 EP disclosed