SCHEMBL21587239

SCHEMBL21587239

c1ccc(-c2ccc(N(c3ccccc3)c3ccc4oc5ccc(N(c6ccccc6)c6ccc(-c7ccccc7)cc6)cc5c4c3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 5/20 0.40
PLA2G4A P47712 5/20 0.40
MAPT P10636 5/20 0.39
KDM4E B2RXH2 4/20 0.39
ALDH1A1 P00352 4/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
CYP3A4 P08684 3/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
NPC1 O15118 3/20 0.38
HPGD P15428 3/20 0.38
RAB9A P51151 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
PGR P06401 1/20 0.38
GAA P10253 2/20 0.37

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
SCHEMBL20335302 0.98 KDM4E (0.41) PLA2G2APLA2G4AMAPTKDM4EALDH1A1
SCHEMBL16639221 0.98 PLA2G2A (0.41) PLA2G2APLA2G4AMAPTKDM4EALDH1A1
SCHEMBL22140590 0.97 PLA2G2A (0.45) PLA2G2APLA2G4AMAPTKDM4EALDH1A1
SCHEMBL14295616 0.97 PLA2G2A (0.45) PLA2G2APLA2G4AMAPTKDM4EALDH1A1
SCHEMBL14295575 0.97 PLA2G2A (0.45) PLA2G2APLA2G4AMAPTKDM4EALDH1A1
SCHEMBL14295622 0.97 PLA2G2A (0.45) PLA2G2APLA2G4AMAPTKDM4EALDH1A1
SCHEMBL23172154 0.95 MAPT (0.46) PLA2G2APLA2G4AMAPTKDM4EALDH1A1
SCHEMBL14295248 0.95 MAPT (0.46) PLA2G2APLA2G4AMAPTKDM4EALDH1A1
SCHEMBL20341869 0.95 PLA2G2A (0.41) PLA2G2APLA2G4AMAPTKDM4EALDH1A1
SCHEMBL14295463 0.95 MAPT (0.46) PLA2G2APLA2G4AMAPTKDM4EALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220119590-A1 POLYMERS WITH AMINE-GROUP-CONTAINING REPEATING UNITS MERCK PATENT GMBH (DE) 2022-04-21 US disclosed
EP-3579292-B1 ORGANIC LIGHT EMITTING DEVICE LG CHEMICAL LTD (KR) 2020-08-05 EP disclosed
EP-3579292-A1 ORGANIC LIGHT EMITTING DEVICE LG Chem, Ltd. (KR) 2019-12-11 EP disclosed