SCHEMBL27449779

SCHEMBL27449779

CNC(=O)C(=NOC)c1cccnc1-c1ccc(CN)cc1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.37
LOXL2 Q9Y4K0 2/20 0.35
KLKB1 P03952 1/20 0.35
HIF1A Q16665 4/20 0.35
PTK2 Q05397 1/20 0.35
ROCK2 O75116 3/20 0.34
SYK P43405 1/20 0.34
P2RX7 Q99572 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PKM P14618 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL27467526 0.74 LMNA (0.47) LMNASMN1; SMN2L3MBTL1
SCHEMBL27451664 0.74 TRPV1 (0.43) HIF1ASYKSMN1; SMN2PKMKDM4E
SCHEMBL11255656 0.70 LMNA (0.47) LMNASMN1; SMN2PKML3MBTL1KDM4E
SCHEMBL11255658 0.70 LMNA (0.47) LMNASMN1; SMN2PKML3MBTL1KDM4E
SCHEMBL8369636 0.70 HIF1A (0.51) HIF1AL3MBTL1KDM4EALDH1A1
SCHEMBL9018933 0.70 HIF1A (0.51) HIF1AL3MBTL1KDM4EALDH1A1
SCHEMBL8369635 0.70 HIF1A (0.51) HIF1AL3MBTL1KDM4EALDH1A1
SCHEMBL8761028 0.69 SIRT2 (0.38) HIF1ALMNAPKMKDM4EALDH1A1
SCHEMBL8368301 0.68 HIF1A (0.49) HIF1ASMN1; SMN2L3MBTL1KDM4EALDH1A1
SCHEMBL8368303 0.68 HIF1A (0.49) HIF1ASMN1; SMN2L3MBTL1KDM4EALDH1A1

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
CN-1133036-A 2-oximino-2-pyridyl acetic acid derivatives as anti-parasitic agents (fungicides) BAYER AG (DE) 1996-10-09 CN disclosed