SCHEMBL24904682

SCHEMBL24904682

c1ccc(-c2ccc(N(c3ccccc3)c3ccc4c(c3)-c3ccccc3C43c4ccccc4C4(c5ccccc5-c5ccccc54)c4ccccc43)cc2-c2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PDK2 Q15119 3/20 0.35
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
OPRK1 P41145 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
THRB P10828 1/20 0.31

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
SCHEMBL22425428 0.98 KDM4E (0.38) KDM4EMAPTTDP1ALDH1A1CYP1A2
SCHEMBL24646507 0.96 PDK2 (0.37) KDM4EMAPTTDP1ALDH1A1CYP1A2
SCHEMBL22425229 0.94 PDK2 (0.39) KDM4EMAPTTDP1ALDH1A1CYP1A2
SCHEMBL22425423 0.94 KDM4E (0.39) KDM4EMAPTTDP1ALDH1A1CYP1A2
SCHEMBL24647653 0.94 KDM4E (0.39) KDM4EMAPTTDP1ALDH1A1CYP1A2
SCHEMBL24905368 0.93 PDK2 (0.37) KDM4EMAPTTDP1ALDH1A1CYP1A2
SCHEMBL22425477 0.93 PDK2 (0.39) KDM4EMAPTTDP1ALDH1A1CYP1A2
SCHEMBL24904869 0.93 PDK2 (0.37) KDM4EMAPTTDP1ALDH1A1CYP1A2
SCHEMBL23449659 0.92 PDK2 (0.38) KDM4EMAPTTDP1ALDH1A1CYP1A2
SCHEMBL20710335 0.92 PDK2 (0.38) KDM4EMAPTTDP1ALDH1A1CYP1A2

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
US-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 US disclosed