SCHEMBL28346237

SCHEMBL28346237

Cc1ccc(N(c2ccc(N)cc2)C(C)CC(C)C)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.46
ALDH1A1 P00352 6/20 0.42
TDP1 Q9NUW8 6/20 0.42
MAPK1 P28482 3/20 0.42
CYP3A4 P08684 3/20 0.42
TP53 P04637 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
TEAD4 Q15561 1/20 0.38
PSMD14 O00487 1/20 0.38
RECQL P46063 1/20 0.38
GFER P55789 1/20 0.38
MAPT P10636 3/20 0.37
POLB P06746 1/20 0.37
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
CA7 P43166 1/20 0.34
HSP90AA1 P07900 1/20 0.34
AGTR1 P30556 1/20 0.34

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
SCHEMBL105667 0.86 ALDH1A1 (0.48) ALDH1A1TDP1MAPK1CYP3A4TP53
SCHEMBL30450079 0.84 CYP3A4 (0.45) ALDH1A1TDP1MAPK1CYP3A4TP53
SCHEMBL24564987 0.84 CYP2C19 (0.43) ACHEALDH1A1TP53TSHRMAPT
SCHEMBL28288839 0.79 CYP3A4 (0.38) ALDH1A1TDP1MAPK1CYP3A4TP53
SCHEMBL26042906 0.79 ACHE (0.56) ACHEALDH1A1TDP1MAPK1CYP3A4
SCHEMBL6439448 0.77 TDP1 (0.48) ACHEALDH1A1TDP1MAPK1CYP3A4
SCHEMBL10414705 0.76 ALDH1A1 (0.52) ACHEALDH1A1TDP1MAPK1CYP3A4
SCHEMBL11478153 0.75 ALDH1A1 (0.39) ALDH1A1TDP1MAPK1CYP3A4TP53
SCHEMBL29763170 0.74 ALDH1A1 (0.45) ACHEALDH1A1TDP1MAPK1CYP3A4
SCHEMBL11468165 0.72 ALDH1A1 (0.37) ALDH1A1TDP1MAPK1CYP3A4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110564312-A Anti-aging and anti-degradation packaging adhesive film for solar cell 马鞍山吉祥光电科技有限公司 2019-12-13 CN claimed
CN-110564312-A Anti-aging and anti-degradation packaging adhesive film for solar cell 马鞍山吉祥光电科技有限公司 2019-12-13 CN disclosed
CN-106032397-A Functionalized diolefin polymer preparation method 中国石油化工股份有限公司 2016-10-19 CN disclosed
CN-106032395-A Functionalized elastomer, modified asphalt, and functionalized elastomer preparation method 中国石油化工股份有限公司 2016-10-19 CN disclosed
CN-104371775-B A kind of method of compositions of additives and Dresel fuel compositions and raising oxidation stability of biodiesel SINOPEC CORP. (CN) 2016-05-25 CN disclosed