SCHEMBL9496487

SCHEMBL9496487

COC(=O)/C(C)=N/Oc1ccccc1Oc1cc(Oc2ccccc2C#N)ncn1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.39
ALDH1A1 P00352 4/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 5/20 0.38
SYK P43405 1/20 0.38
PIN1 Q13526 1/20 0.37
GAA P10253 2/20 0.37
POLB P06746 1/20 0.37
MAPK1 P28482 1/20 0.37
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
MAPK14 Q16539 1/20 0.36
EZH2 Q15910 1/20 0.35
KDM4E B2RXH2 1/20 0.34
TP53 P04637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
DCK P27707 1/20 0.34

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
SCHEMBL9491020 1.00 MAP4K4 (0.39) MAP4K4ALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL9494059 0.80 MAP4K4 (0.41) MAP4K4ALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL6447259 0.80 HIF1A (0.41) MAP4K4ALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL22371494 0.78 MAP4K4 (0.40) MAP4K4ALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL9065463 0.77 MAP4K4 (0.39) MAP4K4ALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL55086 0.77 MAP4K4 (0.39) MAP4K4ALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL24507690 0.77 MAP4K4 (0.56) MAP4K4SYKPIN1GAAPOLB
SCHEMBL8469850 0.77 MAP4K4 (0.39) MAP4K4ALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL21389595 0.77 MAP4K4 (0.39) MAP4K4ALDH1A1HPGDTSHRSMN1; SMN2
SCHEMBL10045475 0.77 MAP4K4 (0.39) MAP4K4ALDH1A1HPGDTSHRSMN1; SMN2

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
US-5206245-A FUNGICIDAL AROMATIC PYRIMIDINYL OXIME ETHERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1993-04-27 US disclosed