SCHEMBL22995668

SCHEMBL22995668

Cc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccccc5c5c4ccc4c6ccccc6n(-c6ccccc6)c45)n3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
KDM4E B2RXH2 6/20 0.40
MAPT P10636 4/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
HPGD P15428 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
RXFP1 Q9HBX9 2/20 0.39
AGTR1 P30556 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
STAT1 P42224 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
FLT3 P36888 1/20 0.36
GAA P10253 2/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.35

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
SCHEMBL15625697 0.94 L3MBTL1 (0.40) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL17248251 0.94 L3MBTL1 (0.40) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL18926280 0.93 ALDH1A1 (0.39) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL12131958 0.92 L3MBTL1 (0.41) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL19769897 0.90 KDM4E (0.36) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL19769859 0.90 L3MBTL1 (0.43) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL19769865 0.90 L3MBTL1 (0.43) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL16260433 0.89 L3MBTL1 (0.38) ALDH1A1KDM4EMAPTKMT2AL3MBTL1
SCHEMBL19769894 0.89 KDM4E (0.37) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL17809373 0.89 L3MBTL1 (0.34) ALDH1A1KDM4EMAPTMEN1KMT2A

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
EP-3553152-B1 MIXTURE, COMPOSITION AND ORGANIC ELECTRONIC DEVICE GUANGZHOU CHINARAY OPTOELECTRONIC MAT LTD (CN) 2021-02-17 EP disclosed