SCHEMBL26686296

SCHEMBL26686296

c1ccc(-c2ccc(-c3nc(-c4cccc(-c5nc(-c6ccccc6)nc(-c6ccc7c(c6)sc6ccccc67)n5)c4)nc(-c4ccc5ccccc5c4)n3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
CYP1A2 P05177 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
RAB9A P51151 1/20 0.40
GPR3 P46089 1/20 0.38
S1PR5 Q9H228 5/20 0.37
S1PR4 O95977 4/20 0.37
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
CYP1A1 P04798 2/20 0.36
CYP1B1 Q16678 2/20 0.36
ADORA2A P29274 1/20 0.36
ADORA1 P30542 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
SCHEMBL24123237 0.99 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL24123198 0.97 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL25817774 0.97 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL23920396 0.97 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL21108854 0.96 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL25817720 0.96 ESR1 (0.39) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL24266748 0.96 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL21450426 0.96 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL21450425 0.96 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E
SCHEMBL21450266 0.96 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2MEN1KMT2AKDM4E

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-20230345755-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2023-10-26 US disclosed
US-20230345755-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2023-10-26 US disclosed