SCHEMBL29339940

SCHEMBL29339940

CC1(C)c2cc(-c3nc(Cl)nc(-c4ccccc4)n3)ccc2-c2ccc3ccccc3c21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.36
▸ KMT2A Q03164 8/20 0.36
▸ ALDH1A1 P00352 6/20 0.36
▸ HPGD P15428 5/20 0.36
▸ L3MBTL1 Q9Y468 5/20 0.36
▸ MAPT P10636 5/20 0.36
▸ KDM4E B2RXH2 4/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ NR1I3 Q14994 1/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.35
▸ LMNA P02545 3/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ ATM Q13315 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ NFKB2 Q00653 1/20 0.34
▸ RELA Q04206 1/20 0.34
▸ GLA P06280 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
SCHEMBL22037580 0.93 MEN1 (0.38) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL23743416 0.93 MEN1 (0.38) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL19885842 0.91 MEN1 (0.37) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL22309436 0.91 MEN1 (0.37) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL22038090 0.90 RARA (0.37) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL19271459 0.89 MEN1 (0.35) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL22309437 0.88 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL22545027 0.88 MAPT (0.36) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL22309956 0.87 MEN1 (0.44) MEN1KMT2AALDH1A1HPGDL3MBTL1
SCHEMBL22309435 0.87 MEN1 (0.44) MEN1KMT2AALDH1A1HPGDL3MBTL1

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
WO-2024150991-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THREREOF 덕산네오룩스 주식회사 2024-07-18 — — WO disclosed
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