SCHEMBL16795265

SCHEMBL16795265

O=C(O)NCCc1cc(Cl)ccc1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.52
HIF1A Q16665 3/20 0.52
ALOX15 P16050 3/20 0.52
KMT2A Q03164 3/20 0.52
MEN1 O00255 2/20 0.52
CYP3A4 P08684 2/20 0.52
HTT P42858 2/20 0.52
SLC22A1 O15245 1/20 0.52
USP2 O75604 1/20 0.52
LMNA P02545 1/20 0.52
HSP90AA1 P07900 1/20 0.52
MAPT P10636 1/20 0.52
HSPD1 P10809 1/20 0.52
HSPA5 P11021 1/20 0.52
IDO1 P14902 1/20 0.52
ALOX12 P18054 1/20 0.52
CASP1 P29466 1/20 0.52
BLM P54132 1/20 0.52
HSPE1 P61604 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL1384166 0.84 HPGD (0.49) HPGDHIF1AALOX15KMT2AMEN1
SCHEMBL1384164 0.84 HPGD (0.49) HPGDHIF1AALOX15KMT2AMEN1
SCHEMBL17330349 0.83 HPGD (0.47) HPGDLMNAPOLBCNR1PLAAT3
SCHEMBL7405242 0.82 HPGD (0.49) HPGDKMT2AMEN1LMNAMAPT
SCHEMBL17330402 0.82 HPGD (0.46) HPGDKMT2AMEN1SMN1; SMN2POLB
SCHEMBL3529974 0.81 HPGD (0.67) HPGDKMT2AMEN1HTTLMNA
SCHEMBL5654926 0.81 HPGD (0.48) HPGDKMT2ACNR1PLAAT3PLAAT5
SCHEMBL1418003 0.79 HIF1A (0.59) HPGDHIF1AALOX15KMT2AMEN1
SCHEMBL19376791 0.79 HPGD (0.49) HPGDKMT2AMEN1LMNASMN1; SMN2
SCHEMBL13840658 0.77 HIF1A (0.62) HPGDHIF1AALOX15KMT2AMEN1

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
WO-2015086693-A1 PYRAZOLOPYRIMIDIN-2-YL DERIVATIVES AS JAK INHIBITORS ALMIRALL, S.A. (ES) 2015-06-18 WO disclosed