SCHEMBL29148507

SCHEMBL29148507

C=CCc1ccc(N(c2ccc(N)cc2)c2ccc(N)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.48
CYP3A4 P08684 7/20 0.48
MAPT P10636 5/20 0.48
TDP1 Q9NUW8 4/20 0.48
CYP1A2 P05177 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
KDM4E B2RXH2 2/20 0.48
CYP2D6 P10635 2/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
TSHR P16473 3/20 0.42
TP53 P04637 2/20 0.42
ALOX15 P16050 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
ALOX12 P18054 1/20 0.42
MAPK1 P28482 3/20 0.42
GFER P55789 2/20 0.42
PSMD14 O00487 1/20 0.42
RECQL P46063 1/20 0.42
XDH P47989 1/20 0.38

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
SCHEMBL716339 0.87 ALDH1A1 (0.52) ALDH1A1CYP3A4MAPTTDP1CYP1A2
Ethylene SCHEMBL27582326 0.85 ALDH1A1 (0.50) ALDH1A1CYP3A4MAPTTDP1CYP1A2
SCHEMBL3791364 0.83 ALDH1A1 (0.45) ALDH1A1CYP3A4MAPTCYP1A2KDM4E
SCHEMBL25703563 0.83 ALDH1A1 (0.48) ALDH1A1CYP3A4MAPTTDP1CYP1A2
SCHEMBL15407026 0.82 ALDH1A1 (0.45) ALDH1A1CYP3A4MAPTTDP1CYP1A2
SCHEMBL3791458 0.82 ALDH1A1 (0.45) ALDH1A1CYP3A4MAPTTDP1CYP1A2
SCHEMBL18104282 0.80 CNR2 (0.48) ALDH1A1CYP3A4MAPTCYP1A2KDM4E
SCHEMBL1327867 0.77 ALDH1A1 (0.41) ALDH1A1CYP3A4MAPTTDP1CYP1A2
SCHEMBL7590353 0.76 ALDH1A1 (0.52) ALDH1A1CYP3A4MAPTTDP1CYP1A2
SCHEMBL28999966 0.76 ALDH1A1 (0.48) ALDH1A1CYP3A4MAPTTDP1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117487213-B Preparation method of polyimide flexible substrate with high strength and low expansion 住井科技(深圳)有限公司 2024-11-22 CN claimed
CN-117487213-A Preparation method of polyimide flexible substrate with high strength and low expansion 住井科技(深圳)有限公司 2024-02-02 CN claimed
CN-117487213-B Preparation method of polyimide flexible substrate with high strength and low expansion 住井科技(深圳)有限公司 2024-11-22 CN disclosed
CN-117487213-A Preparation method of polyimide flexible substrate with high strength and low expansion 住井科技(深圳)有限公司 2024-02-02 CN disclosed