SCHEMBL22700216

SCHEMBL22700216

c1ccc(-c2cc(-c3ccccc3)nc(-c3ccc4sc5c(-c6nc(-c7ccccc7)cc(-c7ccccc7)n6)cccc5c4c3)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
MEN1 O00255 8/20 0.43
KMT2A Q03164 8/20 0.43
MAPT P10636 7/20 0.43
ALDH1A1 P00352 6/20 0.43
HPGD P15428 6/20 0.43
KDM4E B2RXH2 3/20 0.43
LMNA P02545 2/20 0.43
NTSR1 P30989 1/20 0.42
GLA P06280 1/20 0.40
LIMK1 P53667 1/20 0.39
ADORA2A P29274 2/20 0.36
ADORA1 P30542 2/20 0.36
AGTR1 P30556 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP2C19 P33261 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
CYP1A2 P05177 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
SCHEMBL22700217 0.99 ALOX5 (0.43) ALOX5MEN1KMT2AMAPTALDH1A1
SCHEMBL22700227 0.99 ALOX5 (0.43) ALOX5MEN1KMT2AMAPTALDH1A1
SCHEMBL22329658 0.97 MEN1 (0.47) ALOX5MEN1KMT2AMAPTALDH1A1
SCHEMBL22329783 0.97 MEN1 (0.47) ALOX5MEN1KMT2AMAPTALDH1A1
SCHEMBL22700302 0.97 ALOX5 (0.42) ALOX5MEN1KMT2AMAPTALDH1A1
SCHEMBL22700510 0.96 MEN1 (0.46) ALOX5MEN1KMT2AMAPTALDH1A1
SCHEMBL22330125 0.96 MEN1 (0.46) ALOX5MEN1KMT2AMAPTALDH1A1
SCHEMBL22700230 0.96 MEN1 (0.46) ALOX5MEN1KMT2AMAPTALDH1A1
SCHEMBL22700220 0.95 MEN1 (0.45) ALOX5MEN1KMT2AMAPTALDH1A1
SCHEMBL22329625 0.95 MEN1 (0.43) ALOX5MEN1KMT2AMAPTALDH1A1

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
WO-2020235976-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 (KR) 2020-11-26 WO disclosed