SCHEMBL20041720

SCHEMBL20041720

c1ccc(-n2c3ccc(-c4ccc5[nH]c6nc7ccccc7n6c5c4)cc3c3cc(-c4ccc5[nH]c6nc7ccccc7n6c5c4)ccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.43
ALDH1A1 P00352 7/20 0.43
HPGD P15428 7/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
LMNA P02545 2/20 0.43
RAB9A P51151 2/20 0.43
HSD17B10 Q99714 2/20 0.43
GAA P10253 2/20 0.43
NPC1 O15118 1/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
PKM P14618 1/20 0.43
HTT P42858 2/20 0.37
MAPK1 P28482 1/20 0.37
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPK10 P53779 1/20 0.36
ADORA2A P29274 2/20 0.36
ADORA1 P30542 2/20 0.36
ADORA2B P29275 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
SCHEMBL15631678 0.98 KDM4E (0.42) KDM4EALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL25569975 0.85 ALDH1A1 (0.55) KDM4EALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL20041553 0.85 KDM4E (0.50) KDM4EALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL20893154 0.84 MGAM (0.40) KDM4EGAAATML3MBTL1MGAM
SCHEMBL20041527 0.82 KDM4E (0.51) KDM4EALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL15631625 0.81 KDM4E (0.44) KDM4EALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL20041534 0.80 NPC1 (0.35) KDM4EALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL20893112 0.80 NPY5R (0.39) KDM4EGAAATML3MBTL1PGR
SCHEMBL22357668 0.78 KDM4E (0.46) KDM4EALDH1A1HPGDSMN1; SMN2LMNA
SCHEMBL16693319 0.78 CHEK2 (0.44) KDM4EALDH1A1HPGDSMN1; SMN2LMNA

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
EP-2982676-B1 Benzimidazo[2,1-B]benzoxazoles for electronic applications IDEMITSU KOSAN CO (JP) 2018-04-11 EP disclosed