SCHEMBL21394110

SCHEMBL21394110

c1ccc(-c2ccc(-c3cccc(-c4nc(-c5ccccc5)nc(-c5cc6ccccc6c6ccccc56)n4)c3)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.45
ALDH1A1 P00352 5/20 0.41
HPGD P15428 5/20 0.41
MAPT P10636 5/20 0.41
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
KDM4E B2RXH2 3/20 0.40
TSHR P16473 3/20 0.40
MAPK1 P28482 2/20 0.40
ATM Q13315 2/20 0.40
HSD17B10 Q99714 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 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
GLA P06280 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
SCHEMBL24306965 1.00 CYP11B1 (0.45) CYP11B1ALDH1A1HPGDMAPTMEN1
SCHEMBL21394557 0.98 CYP11B1 (0.46) CYP11B1ALDH1A1HPGDMAPTMEN1
SCHEMBL21394558 0.98 CYP11B1 (0.46) CYP11B1ALDH1A1HPGDMAPTMEN1
SCHEMBL24306963 0.98 CYP11B1 (0.46) CYP11B1ALDH1A1HPGDMAPTMEN1
SCHEMBL27455636 0.97 CYP11B1 (0.47) CYP11B1ALDH1A1HPGDMAPTMEN1
SCHEMBL21394179 0.94 CYP11B1 (0.49) CYP11B1ALDH1A1HPGDMAPTMEN1
SCHEMBL15458302 0.94 CYP11B1 (0.49) CYP11B1ALDH1A1HPGDMAPTMEN1
SCHEMBL16305264 0.94 CYP11B1 (0.45) CYP11B1ALDH1A1HPGDMAPTMEN1
SCHEMBL21394459 0.94 CYP11B1 (0.49) CYP11B1ALDH1A1HPGDMAPTMEN1
SCHEMBL21394178 0.94 CYP11B1 (0.49) CYP11B1ALDH1A1HPGDMAPTMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11239425-B2 Organic light emitting device LG CHEM, LTD. (KR) 2022-02-01 US disclosed
US-20190296243-A1 ORGANIC LIGHT EMITTING DEVICE LG CHEM, LTD. (KR) 2019-09-26 US disclosed