SCHEMBL24473151

SCHEMBL24473151

c1ccc(-c2nc(-c3ccccc3)nc(-c3cc4c(ccc5ccc6ccccc6c54)c4ccccc34)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
RECQL P46063 1/20 0.41
HPRT1 P00492 3/20 0.41
HPGD P15428 5/20 0.40
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
HSD17B10 Q99714 3/20 0.40
TSHR P16473 3/20 0.40
ATM Q13315 3/20 0.40
MAPK1 P28482 2/20 0.40
TP53 P04637 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL24472927 0.92 MAPT (0.39) MAPTSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL24473027 0.92 ALDH1A1 (0.40) MAPTSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL24472941 0.92 ALDH1A1 (0.43) MAPTSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL24472944 0.89 ALDH1A1 (0.40) MAPTSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL19271418 0.88 HPRT1 (0.50) MAPTSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL24473031 0.88 MAPT (0.38) MAPTSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL24472933 0.87 KDM4E (0.42) MAPTSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL24472832 0.87 ALDH1A1 (0.38) MAPTSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL17995351 0.87 HPRT1 (0.48) MAPTSMN1; SMN2RAB9ANPC1LMNA
SCHEMBL12144395 0.87 MAPT (0.44) MAPTSMN1; SMN2RAB9ANPC1LMNA

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-20220173322-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, A PLURALITY OF HOST MATERIALS COMPRISING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2022-06-02 US disclosed