SCHEMBL24849044

SCHEMBL24849044

c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4nc(-c5ccc6c(c5)oc5c6ccc6c7ccccc7oc65)c5sc6ccccc6c5n4)cc3)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.36
POLB P06746 3/20 0.36
KDM4E B2RXH2 3/20 0.36
MAPT P10636 10/20 0.35
KMT2A Q03164 7/20 0.35
LMNA P02545 5/20 0.35
TSHR P16473 4/20 0.35
HTT P42858 1/20 0.35
HPGD P15428 2/20 0.34
NPSR1 Q6W5P4 3/20 0.33
HSD17B10 Q99714 3/20 0.33
USP2 O75604 1/20 0.33
ESR2 Q92731 1/20 0.32
MEN1 O00255 6/20 0.32
MAPK1 P28482 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
GAA P10253 2/20 0.32

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
SCHEMBL25979975 0.92 LIMK1 (0.32) LIMK1
SCHEMBL25980398 0.91 POLB (0.32) ALDH1A1POLBKDM4EMAPTKMT2A
SCHEMBL25979455 0.91 LIMK1 (0.33) ALDH1A1POLBKDM4EHPGDLIMK1
SCHEMBL25979959 0.89 LIMK1 (0.33) ESR2LIMK1
SCHEMBL26779187 0.88 LIMK1 (0.33) LIMK1
SCHEMBL25980397 0.87 ESR2 (0.31) POLBMAPTKMT2ALMNATSHR
SCHEMBL26416508 0.87 PRKDC (0.34) ESR2LIMK1
SCHEMBL26779000 0.85 PRKDC (0.31) POLBMAPTKMT2ALMNATSHR
SCHEMBL24255937 0.85 LIMK1 (0.32) CYP1A2LIMK1
SCHEMBL25978618 0.85 PRKDC (0.31) POLBMAPTKMT2ALMNATSHR

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-2023277446-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER 엘티소재주식회사 2023-01-05 WO disclosed