SCHEMBL19044871

SCHEMBL19044871

c1ccc(-n2c3ccccc3c3c4ccccc4c4c(c5ccccc5n4-c4nc5c6c(cccc6n4)Oc4ccccc4-5)c32)cc1

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.32
HTT P42858 1/20 0.32
KDM4E B2RXH2 2/20 0.31
ATM Q13315 2/20 0.31
PRKACA P17612 1/20 0.31
RPS6KB1 P23443 1/20 0.31
GSK3B P49841 1/20 0.31
ROCK1 Q13464 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
LMNA P02545 1/20 0.30

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
SCHEMBL19044700 1.00 MAPK1 (0.32) MAPK1HTTKDM4EATMPRKACA
SCHEMBL19044697 0.95 MAPK1 (0.33) MAPK1HTTKDM4EATMPRKACA
SCHEMBL19044706 0.95 MAPK1 (0.33) MAPK1HTTKDM4EATMPRKACA
SCHEMBL19045467 0.94 MAPK1 (0.33) MAPK1HTTKDM4EATMPRKACA
SCHEMBL19045471 0.94 MAPK1 (0.33) MAPK1HTTKDM4EATMPRKACA
SCHEMBL19045218 0.92 KDM4E (0.35) MAPK1KDM4EATM
SCHEMBL19044523 0.91 KDM4E (0.35) MAPK1HTTKDM4EATMPRKACA
SCHEMBL19045597 0.91 KDM4E (0.35) MAPK1HTTKDM4EATMPRKACA
SCHEMBL21699444 0.89 KDM4E (0.32) MAPK1KDM4EATML3MBTL1LMNA
SCHEMBL19044695 0.89 KDM4E (0.35) MAPK1HTTKDM4EATMPRKACA

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
EP-3394062-B1 HETERO-CONDENSED PHENYLQUINAZOLINES AND THEIR USE IN ELECTRONIC DEVICES IDEMITSU KOSAN CO (JP) 2019-10-02 EP disclosed
WO-2017109727-A1 HETERO-CONDENSED PHENYLQUINAZOLINES AND THEIR USE IN ELECTRONIC DEVICES IDEMITSU KOSAN CO., LTD. (JP) 2017-06-29 WO disclosed