SCHEMBL30711136

SCHEMBL30711136

[N].c1ncc2sccc2n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 1/20 0.39
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
EGFR P00533 9/20 0.39
ALDH1A1 P00352 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
PPARG P37231 1/20 0.36
HTT P42858 1/20 0.36
NCOA2 Q15596 1/20 0.36
NCOA1 Q15788 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NCOA3 Q9Y6Q9 1/20 0.36
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.31
HTR2C P28335 1/20 0.31
ICAM1 P05362 1/20 0.31
SELE P16581 1/20 0.31
VCAM1 P19320 1/20 0.31

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
SCHEMBL32388 0.98
SCHEMBL27747567 0.98 AXL (0.41) AXLMKNK1MKNK2EGFRALDH1A1
Hydrochloric Acid SCHEMBL21803551 0.96 AXL (0.39) AXLMKNK1MKNK2EGFRALDH1A1
Hydrazine SCHEMBL5897595 0.94 AXL (0.38) AXLMKNK1MKNK2EGFRALDH1A1
Formaldehyde SCHEMBL28037402 0.92 AXL (0.37) AXLMKNK1MKNK2EGFRALDH1A1
Pyrimidine SCHEMBL27714628 0.88 EGFR (0.38) AXLMKNK1MKNK2EGFRALDH1A1
Piperazine SCHEMBL21803298 0.87 HTR2C (0.43) AXLMKNK1MKNK2EGFRALDH1A1
Urea SCHEMBL28122176 0.87 AXL (0.34) AXLMKNK1MKNK2EGFRALDH1A1
Pyridine SCHEMBL27578790 0.87 EGFR (0.37) AXLMKNK1MKNK2EGFRALDH1A1
Acetic Acid SCHEMBL474261 0.85 ADORA2A (0.35) AXLMKNK1MKNK2EGFRALDH1A1

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-111868053-B Novel compound and organic light emitting device comprising the same 株式会社LG化学 2023-11-28 CN disclosed