SCHEMBL19986199

SCHEMBL19986199

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5c6c7ccccc7c7ccccc7c6c6c7ccccc7oc6c54)c3)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.34
ALDH1A1 P00352 5/20 0.34
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
KDM4E B2RXH2 3/20 0.34
LMNA P02545 3/20 0.34
HPGD P15428 3/20 0.34
TSHR P16473 3/20 0.33
HSD17B10 Q99714 2/20 0.31
MAPK1 P28482 1/20 0.31
POLB P06746 2/20 0.31
NTSR1 P30989 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
BRCA1 P38398 1/20 0.31

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
SCHEMBL19039799 0.94 MAPT (0.36) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL19986122 0.94 MAPT (0.36) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL17405639 0.92 MAPT (0.35) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL17405251 0.91 ALDH1A1 (0.34) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL17406086 0.91 ALDH1A1 (0.34) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL19986127 0.91 MEN1 (0.32) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL17405521 0.91 MAPT (0.36) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL17405721 0.90 ALDH1A1 (0.35) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL17405376 0.90 ALDH1A1 (0.35) MAPTALDH1A1MEN1KMT2AKDM4E
SCHEMBL17405780 0.90 ALDH1A1 (0.35) MAPTALDH1A1MEN1KMT2AKDM4E

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-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed
US-20180083202-A1 COMPOUND FOR ORGANIC OPTOELECTRIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRIC DEVICE AND ORGANIC OPTOELECTRIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2018-03-22 US disclosed