SCHEMBL22700206

SCHEMBL22700206

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc4c3sc3cccc(-c5nc(-c6ccccc6)nc(-c6ccccc6)n5)c34)n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 10/20 0.45
KMT2A Q03164 10/20 0.45
ALDH1A1 P00352 7/20 0.45
HPGD P15428 7/20 0.45
MAPT P10636 7/20 0.45
KDM4E B2RXH2 4/20 0.43
LMNA P02545 3/20 0.43
GLA P06280 1/20 0.43
NTSR1 P30989 1/20 0.42
ADORA2A P29274 4/20 0.40
ADORA1 P30542 4/20 0.40
LIMK1 P53667 1/20 0.39
ALOX5 P09917 1/20 0.38
TDP1 Q9NUW8 3/20 0.36
MAPK1 P28482 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TSHR P16473 2/20 0.35
ADORA3 P0DMS8 1/20 0.35
ALOX15 P16050 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
SCHEMBL22329276 1.00 MEN1 (0.45) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22329199 0.97 MEN1 (0.47) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22329984 0.96 MEN1 (0.44) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22700196 0.96 LIMK1 (0.41) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22329274 0.95 MEN1 (0.47) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22700570 0.95 MEN1 (0.43) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22700585 0.95 MEN1 (0.47) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22329390 0.95 MEN1 (0.47) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22329275 0.95 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22700194 0.95 MEN1 (0.42) MEN1KMT2AALDH1A1HPGDMAPT

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