SCHEMBL25975503

SCHEMBL25975503

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4oc5cc(N(c6ccccc6)c6ccc(-c7cc8ccccc8c8ccccc78)cc6)ccc5c34)n2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.33
CRHR1 P34998 1/20 0.32
ALDH1A1 P00352 5/20 0.32
KDM4E B2RXH2 5/20 0.32
MAPT P10636 4/20 0.32
HPGD P15428 3/20 0.32
TSHR P16473 2/20 0.32
MAPK1 P28482 2/20 0.32
HSD17B10 Q99714 2/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
TP53 P04637 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
ATM Q13315 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
RAB9A P51151 3/20 0.32
MAOB P27338 1/20 0.32

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
SCHEMBL25975616 0.93 CYP11B1 (0.33) CYP11B1CRHR1ALDH1A1KDM4EMAPT
SCHEMBL25975506 0.93 MAPT (0.34) ALDH1A1KDM4EMAPTHPGDTSHR
SCHEMBL26420463 0.90 MAPT (0.33) CRHR1ALDH1A1KDM4EMAPTHPGD
SCHEMBL24255592 0.90 MAPT (0.33) CRHR1ALDH1A1KDM4EMAPTHPGD
SCHEMBL24255591 0.90 MAPT (0.33) CRHR1ALDH1A1KDM4EMAPTHPGD
SCHEMBL24255590 0.90 MAPT (0.34) CRHR1ALDH1A1KDM4EMAPTHPGD
SCHEMBL24255641 0.90 ALDH1A1 (0.38) CRHR1ALDH1A1KDM4EMAPTHPGD
SCHEMBL26420455 0.89 CRHR1 (0.32) CRHR1ALDH1A1KDM4EMAPTHPGD
SCHEMBL25852800 0.89 ALDH1A1 (0.40) CRHR1ALDH1A1KDM4EMAPTHPGD
SCHEMBL24255618 0.89 AHR (0.35) CRHR1ALDH1A1KDM4EMAPTHPGD

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-2023149718-A1 ORGANIC LIGHT-EMITTING ELEMENT INCLUDING HETEROCYCLIC COMPOUND, COMPOSITION FOR ORGANIC MATERIAL LAYER OF ORGANIC LIGHT-EMITTING ELEMENT, AND METHOD FOR MANUFACTURING ORGANIC LIGHT-EMITTING ELEMENT 엘티소재주식회사 2023-08-10 WO disclosed