SCHEMBL9706059

SCHEMBL9706059

COC(=O)Oc1cc(OC(=O)OCc2ccccc2)ccn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
HTT P42858 1/20 0.49
GFER P55789 1/20 0.49
KMT2A Q03164 1/20 0.49
HSD17B10 Q99714 1/20 0.49
ACACB O00763 1/20 0.41
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.39
JMJD6 Q6NYC1 1/20 0.39
HTR2A P28223 1/20 0.39
LTA4H P09960 1/20 0.39
RAB9A P51151 3/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
NPC1 O15118 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
PKM P14618 1/20 0.38
ATM Q13315 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL8782175 0.94 KMT2A (0.54) MEN1HTTGFERKMT2AHSD17B10
SCHEMBL9845133 0.88 KMT2A (0.52) MEN1HTTGFERKMT2AHSD17B10
SCHEMBL9367677 0.88 KMT2A (0.49) MEN1HTTGFERKMT2AHSD17B10
SCHEMBL9367697 0.86 KMT2A (0.50) MEN1HTTGFERKMT2AHSD17B10
SCHEMBL9568958 0.84 AAK1 (0.38) MEN1KMT2AHSD17B10ACACBALDH1A1
SCHEMBL9573013 0.80 KDM4E (0.36) HSD17B10ACACBALDH1A1LMNAHPGD
SCHEMBL9662430 0.78 LMNA (0.36) HTTKMT2AHSD17B10ALDH1A1POLB
SCHEMBL19664384 0.77 KMT2A (0.45) MEN1KMT2AALDH1A1POLBJMJD6
SCHEMBL9663046 0.76 TSHR (0.38) KMT2AACACBLMNATSHR
SCHEMBL7871639 0.76 AAK1 (0.35) KMT2AHSD17B10ACACBALDH1A1HPGD

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-0479177-A2 4- or 5-substituted pyridine-2-carboxylic acids, process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1992-04-08 EP disclosed