SCHEMBL25943019

SCHEMBL25943019

Cc1cccc2c1c1ccccc1n2-c1ccc2c3ccccc3c3ccccc3c2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.40
MAPT P10636 2/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALKBH5 Q6P6C2 1/20 0.38
FTO Q9C0B1 1/20 0.38
ALDH1A1 P00352 4/20 0.34
LMNA P02545 1/20 0.34
PKM P14618 1/20 0.34
IDO1 P14902 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34
MDM2 Q00987 1/20 0.34
MCL1 Q07820 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP2A6 P11509 2/20 0.33
CYP1A2 P05177 2/20 0.33
NQO2 P16083 1/20 0.33
POLB P06746 2/20 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
SCHEMBL4402782 0.86 KDM4E (0.55) KDM4EMAPTATML3MBTL1ALKBH5
SCHEMBL20115841 0.85 ALKBH5 (0.47) KDM4EMAPTATML3MBTL1ALKBH5
SCHEMBL26226125 0.85 KDM4E (0.40) KDM4EMAPTATML3MBTL1ALKBH5
SCHEMBL20115878 0.85 ALKBH5 (0.47) KDM4EMAPTATML3MBTL1ALKBH5
SCHEMBL19359874 0.84 KDM4E (0.47) KDM4EMAPTATML3MBTL1ALDH1A1
SCHEMBL17694822 0.84 ALDH1A1 (0.40) KDM4EMAPTATML3MBTL1ALKBH5
SCHEMBL26519479 0.84 KDM4E (0.42) KDM4EMAPTATML3MBTL1ALKBH5
SCHEMBL17636103 0.83 KDM4E (0.47) KDM4EMAPTATML3MBTL1ALKBH5
SCHEMBL19298659 0.83 KDM4E (0.47) KDM4EMAPTATML3MBTL1ALKBH5
SCHEMBL883413 0.83 KDM4E (0.61) KDM4EMAPTATML3MBTL1ALKBH5

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-11706983-B2 Organic light-emitting device SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-07-18 US disclosed
US-11706983-B2 Organic light-emitting device SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-07-18 US disclosed