SCHEMBL10692720

SCHEMBL10692720

COc1ccc(CCc2ccccc2NC(=O)CO)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.57
RAB9A P51151 2/20 0.55
ABCB1 P08183 1/20 0.53
HDAC1 Q13547 2/20 0.51
NCOR2 Q9Y618 2/20 0.51
HDAC3 O15379 1/20 0.51
ALDH1A1 P00352 5/20 0.50
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
POLB P06746 2/20 0.50
LMNA P02545 1/20 0.50
ATM Q13315 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GRK2 P25098 1/20 0.50
PPARG P37231 1/20 0.50
CTDSP1 Q9GZU7 1/20 0.50
NR2E3 Q9Y5X4 1/20 0.50
MAPT P10636 2/20 0.48
USP2 O75604 1/20 0.48
TSHR P16473 1/20 0.48

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
SCHEMBL10690936 0.88 ALDH1A1 (0.56) GAARAB9ANCOR2ALDH1A1KMT2A
SCHEMBL10693447 0.85 SMN1; SMN2 (0.54) GAARAB9AABCB1HDAC1NCOR2
SCHEMBL10690219 0.84 ALDH1A1 (0.59) GAARAB9AABCB1HDAC1ALDH1A1
SCHEMBL10693467 0.83 ABCB1 (0.55) GAAABCB1ALDH1A1KMT2AMEN1
SCHEMBL8284769 0.76 HDAC3 (0.44) GAAABCB1HDAC1HDAC3ALDH1A1
SCHEMBL8284763 0.75 SLC16A3 (0.49) ABCB1HDAC1HDAC3ALDH1A1KMT2A
SCHEMBL10692512 0.74 HDAC3 (0.63) GAAHDAC1HDAC3ALDH1A1KMT2A
SCHEMBL8803691 0.74 SMN1; SMN2 (0.54) GAARAB9AABCB1ALDH1A1KMT2A
SCHEMBL3555921 0.73 ALDH1A1 (0.65) RAB9AALDH1A1KMT2AMEN1MAPT
SCHEMBL4681910 0.73 ALDH1A1 (0.62) GAARAB9ANCOR2ALDH1A1KMT2A

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-0098743-B1 PHENYL ALPHA-ACYLOXYACETAMIDE DERIVATES AND THEIR THERAPEUTIC USE Yu, Ruey J., Dr. (US) 1988-09-28 EP claimed