SCHEMBL1658699

SCHEMBL1658699

Cn1cc(C(=O)OCc2ccccc2Cl)c(O)cc1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.53
BAZ2B Q9UIF8 1/20 0.52
BAZ2A Q9UIF9 1/20 0.52
CASP3 P42574 2/20 0.52
SENP8 Q96LD8 2/20 0.52
SENP7 Q9BQF6 2/20 0.52
SENP6 Q9GZR1 2/20 0.52
ALDH1A1 P00352 2/20 0.50
HTT P42858 1/20 0.50
NPC1 O15118 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP12 P39900 1/20 0.46
RAB9A P51151 3/20 0.46
MAPT P10636 3/20 0.46
TDP1 Q9NUW8 2/20 0.42
CYP1A2 P05177 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
SCHEMBL27600762 0.79 CASP3 (0.69) L3MBTL1CASP3SENP8SENP7SENP6
SCHEMBL10894226 0.78 SERPINE1 (0.59) L3MBTL1CASP3SENP8SENP7SENP6
SCHEMBL28254056 0.77 CASP3 (0.68) L3MBTL1CASP3SENP8SENP7SENP6
SCHEMBL28884251 0.77 L3MBTL1 (0.72) L3MBTL1CASP3SENP8SENP7SENP6
SCHEMBL388580 0.76 BAZ2B (0.70) L3MBTL1BAZ2BBAZ2AALDH1A1MEN1
SCHEMBL1662612 0.75 MEN1 (0.51) BAZ2BBAZ2AALDH1A1NPC1MEN1
SCHEMBL1660016 0.75 TDP1 (0.47) L3MBTL1BAZ2BBAZ2AALDH1A1HTT
SCHEMBL1642110 0.73 HSP90AA1 (0.48) ALDH1A1NPC1MEN1KMT2ARAB9A
SCHEMBL1660685 0.72 TSHR (0.53) L3MBTL1BAZ2BBAZ2AALDH1A1MEN1
SCHEMBL1659999 0.72 MMP12 (0.46) BAZ2BBAZ2ANPC1KMT2AMMP1

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
EP-2306828-A1 PROLYL HYDROXYLASE INHIBITORS Glaxosmithkline LLC (US) 2011-04-13 EP disclosed
WO-2009158315-A1 PROLYL HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2009-12-30 WO disclosed