SCHEMBL18917196

SCHEMBL18917196

CCOC(=O)Oc1ccnnc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.44
ALDH1A1 P00352 1/20 0.40
CA2 P00918 1/20 0.39
MEN1 O00255 2/20 0.38
POLB P06746 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38
MMP8 P22894 1/20 0.38
MMP14 P50281 1/20 0.38
SOAT1 P35610 1/20 0.38
PSMB5 P28074 2/20 0.36
CCNC P24863 1/20 0.36
CDK8 P49336 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
CYP1A2 P05177 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 2/20 0.36
NLRP3 Q96P20 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36

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
SCHEMBL27698258 0.80 KMT2A (0.47) KMT2AALDH1A1CA2MEN1MMP2
SCHEMBL9521880 0.78 CCNC (0.58) KMT2AALDH1A1MEN1POLBCCNC
SCHEMBL6451238 0.77 ALDH1A1 (0.55) KMT2AALDH1A1CA2MEN1POLB
Hydrochloric Acid SCHEMBL9839090 0.77 CCNC (0.57) KMT2AALDH1A1MEN1POLBCCNC
SCHEMBL20322869 0.77 GAA (0.53) ALDH1A1POLBHSD17B10MAPTTSHR
SCHEMBL27972799 0.76 LMNA (0.47) KMT2AALDH1A1MEN1POLBHCAR2
SCHEMBL19664385 0.75 KMT2A (0.43) KMT2AALDH1A1CA2MEN1POLB
SCHEMBL185926 0.74 HCAR2 (0.48) KMT2AMEN1HCAR2HSD17B10LMNA
SCHEMBL19664384 0.73 KMT2A (0.45) KMT2AALDH1A1CA2MEN1POLB
SCHEMBL27805453 0.73 HCAR2 (0.46) KMT2AALDH1A1CA2L3MBTL1SOAT1

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-2807162-B1 SUBSTITUTED PHENYLIMIDAZOPYRAZOLES AND USE THEREOF Bayer Pharma AG (DE) 2017-06-07 EP disclosed