SCHEMBL22700772

SCHEMBL22700772

c1ccc(-c2cc(-c3cccc4c3sc3cc(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c5)ccc34)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.44
KMT2A Q03164 7/20 0.44
MAPT P10636 7/20 0.44
ALDH1A1 P00352 5/20 0.44
HPGD P15428 5/20 0.44
KDM4E B2RXH2 3/20 0.43
LMNA P02545 3/20 0.43
GLA P06280 1/20 0.43
NTSR1 P30989 1/20 0.41
ALOX5 P09917 1/20 0.40
LIMK1 P53667 4/20 0.38
MAOB P27338 3/20 0.37
MAOA P21397 2/20 0.37
ADORA2A P29274 1/20 0.36
ADORA1 P30542 1/20 0.36
LIMK2 P53671 1/20 0.36
CYP2C19 P33261 3/20 0.35
NPSR1 Q6W5P4 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 2/20 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
SCHEMBL22700549 0.97 MEN1 (0.47) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22329974 0.96 MEN1 (0.46) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22700441 0.96 MEN1 (0.46) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22700548 0.96 MEN1 (0.44) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22700285 0.95 MEN1 (0.44) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL24216633 0.95 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22700557 0.95 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22700533 0.95 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22330167 0.94 MEN1 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22330172 0.94 ALOX5 (0.47) MEN1KMT2AMAPTALDH1A1HPGD

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