SCHEMBL22700607

SCHEMBL22700607

c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4ccc5sc6cc(-c7cc(-c8ccccc8)nc(-c8cccc(-c9ccc(-c%10cc(-c%11ccccc%11)nc(-c%11ccc%12sc%13cc(-c%14cc(-c%15ccccc%15)nc(-c%15ccc(-c%16ccccc%16)cc%15)n%14)ccc%13c%12c%11)n%10)cc9)c8)n7)ccc6c5c4)n3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.46
KMT2A Q03164 7/20 0.46
ALDH1A1 P00352 6/20 0.46
HPGD P15428 6/20 0.46
MAPT P10636 5/20 0.46
KDM4E B2RXH2 4/20 0.46
LMNA P02545 2/20 0.46
GLA P06280 1/20 0.46
NTSR1 P30989 1/20 0.44
PIM3 Q86V86 1/20 0.40
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
ROCK1 Q13464 1/20 0.39
MAOA P21397 3/20 0.38
MAOB P27338 3/20 0.38
USP2 O75604 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
HTT P42858 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL22700606 1.00 MEN1 (0.46) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22700602 1.00 MEN1 (0.46) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22330016 0.99 MEN1 (0.48) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22700733 0.97 MEN1 (0.49) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22329524 0.97 MEN1 (0.48) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22700246 0.97 MEN1 (0.48) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22700753 0.96 MEN1 (0.49) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22329525 0.96 MEN1 (0.49) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22700251 0.96 MEN1 (0.45) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL22329983 0.96 MEN1 (0.47) 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