SCHEMBL25866849

SCHEMBL25866849

CCCCCCC1(CCCCCC)c2ccccc2-c2ccc(N(c3ccccc3)c3cccc(-c4cccc(-c5cccc(N(c6cccc(-c7ccccc7)c6)c6cccc(-c7cccc(-c8cccc(N(c9ccccc9)c9ccccc9)c8)c7)c6)c5)c4)c3)cc21

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 6/20 0.34
MMP2 P08253 4/20 0.34
MMP9 P14780 4/20 0.34
MMP8 P22894 2/20 0.33
MMP13 P45452 2/20 0.33
MGLL Q99685 1/20 0.33
APEX1 P27695 1/20 0.33
LTB4R2 Q9NPC1 1/20 0.31
PTGES O14684 2/20 0.30
ALOX5 P09917 2/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
MEN1 O00255 1/20 0.30
RECQL P46063 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
SOAT1 P35610 1/20 0.30

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
SCHEMBL25866822 0.99 MMP2 (0.36) PDK2MMP2MMP9MMP8MMP13
SCHEMBL13836735 0.95 PDK2 (0.40) PDK2MMP2MMP9MMP8MMP13
SCHEMBL13028002 0.94 MMP2 (0.38) PDK2MMP2MMP9MMP8MMP13
SCHEMBL20315359 0.94 MMP2 (0.38) PDK2MMP2MMP9MMP8MMP13
SCHEMBL13837033 0.94 PDK2 (0.41) PDK2MMP2MMP9MMP8MMP13
SCHEMBL25866809 0.94 MMP2 (0.32) PDK2MMP2MMP9MMP8MMP13
SCHEMBL18373669 0.93 PDK2 (0.36) PDK2MMP2MMP9MMP8MMP13
SCHEMBL25866852 0.93 GPR3 (0.37) MMP2MMP9MMP8MMP13
SCHEMBL13700814 0.92 PDK2 (0.36) PDK2MMP2MMP9MMP8MMP13
SCHEMBL16285551 0.92 PDK2 (0.36) PDK2MMP2MMP9MMP8MMP13

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-11702542-B2 Composition including polymer, interlayer prepared from the composition, and device comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2023-07-18 US disclosed