SCHEMBL20169567

SCHEMBL20169567

C=N/C(=C\C=C/C)c1cc(-c2cc(-c3cccc(-c4ccccc4)n3)nc(-c3cccc(-c4ccccc4)n3)c2)cc(-c2ccccn2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KAT6A Q92794 4/20 0.35
▸ KDM4E B2RXH2 4/20 0.34
▸ LMNA P02545 4/20 0.34
▸ SMN1; SMN2 Q16637 4/20 0.34
▸ HTT P42858 3/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ ALPL P05186 1/20 0.34
▸ HSP90AA1 P07900 1/20 0.34
▸ ALPI P09923 1/20 0.34
▸ ALPG P10696 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ CCR1 P32246 1/20 0.34
▸ CCR5 P51681 1/20 0.34
▸ CCR8 P51685 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ CNR1 P21554 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HIF1A Q16665 5/20 0.33

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
SCHEMBL22650171 0.87 KDM4E (0.36) KAT6AKDM4ELMNASMN1; SMN2HTT
SCHEMBL22147418 0.84 CNR1 (0.37) KAT6AKDM4ETDP1CNR1SCN9A
SCHEMBL20901161 0.82 HSD17B1 (0.34) KDM4EMAPTMEN1KMT2A
SCHEMBL21215947 0.82 SIRT2 (0.34) KDM4ELMNASMN1; SMN2HTTMAPK1
SCHEMBL24762515 0.82 CNR2 (0.32) KAT6AKDM4ELMNASMN1; SMN2HTT
SCHEMBL21099046 0.81 DHODH (0.34) KAT6AKDM4ELMNASMN1; SMN2HTT
SCHEMBL20169564 0.81 KDM4E (0.37) KDM4ELMNASMN1; SMN2HTTTDP1
SCHEMBL21743331 0.80 HSP90AA1 (0.35) KDM4ELMNASMN1; SMN2HTTMAPK1
SCHEMBL25887036 0.79 HIF1A (0.34) KDM4ELMNASMN1; SMN2HTTMAPK1
SCHEMBL21098947 0.79 SIRT2 (0.33) KAT6AKDM4ESMN1; SMN2MAPK1TP53

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
US-9978955-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-05-22 — — US disclosed
Send feedback