SCHEMBL22926650

SCHEMBL22926650

Cc1ccc2c3ccccc3n(-c3cc(-n4c5ccccc5c5ccccc54)nc(-n4c5ccccc5c5ccccc54)n3)c2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.37
MAPT P10636 4/20 0.37
LMNA P02545 3/20 0.37
HTT P42858 1/20 0.37
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
GABRP O00591 1/20 0.36
GABRD O14764 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB1 P18505 1/20 0.36
GABRG2 P18507 1/20 0.36
GABRB3 P28472 1/20 0.36
GABRA5 P31644 1/20 0.36
GABRA3 P34903 1/20 0.36
GABRA2 P47869 1/20 0.36
GABRB2 P47870 1/20 0.36
GABRA4 P48169 1/20 0.36
GABRE P78334 1/20 0.36
GABRA6 Q16445 1/20 0.36
GABRG1 Q8N1C3 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
SCHEMBL22926651 1.00 AURKA (0.37) AURKAMAPTLMNAHTTALDH1A1
SCHEMBL22926648 0.91 MEN1 (0.40) AURKAMAPTLMNAHTTALDH1A1
SCHEMBL22926652 0.91 MEN1 (0.40) AURKAMAPTLMNAHTTALDH1A1
SCHEMBL14407561 0.90 LMNA (0.41) AURKAMAPTLMNAHTTALDH1A1
SCHEMBL22926684 0.90 LMNA (0.41) AURKAMAPTLMNAHTTALDH1A1
SCHEMBL11892555 0.87 KDM4E (0.45) MAPTLMNAHTTALDH1A1SMN1; SMN2
SCHEMBL25640703 0.86 LMNA (0.38) AURKAMAPTLMNAHTTALDH1A1
SCHEMBL27058777 0.84 PTGDR2 (0.38) AURKAMAPTLMNAHTTALDH1A1
SCHEMBL22926698 0.83 LMNA (0.38) MAPTLMNAHTTALDH1A1SMN1; SMN2
SCHEMBL16193241 0.82 KMT2A (0.39) MAPTLMNAHTTSMN1; SMN2KDM4E

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-20210028376-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2021-01-28 US disclosed