SCHEMBL20527595

SCHEMBL20527595

CCCCN(CCCC)C(N(CCCC)CCCC)=[N+](C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.44
CA1 P00915 4/20 0.44
CA9 Q16790 4/20 0.44
ALDH1A1 P00352 2/20 0.44
ALDH2 P05091 1/20 0.44
CA2 P00918 2/20 0.41
MMP1 P03956 1/20 0.41
MMP2 P08253 1/20 0.41
MMP3 P08254 1/20 0.41
MMP8 P22894 1/20 0.41
MGLL Q99685 1/20 0.34
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
DNM1 Q05193 1/20 0.31
GRIN2D O15399 1/20 0.31
GRIN3B O60391 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2A Q12879 1/20 0.31
GRIN2B Q13224 1/20 0.31
GRIN2C Q14957 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
SCHEMBL7035338 0.91 CA12 (0.41) CA12CA1CA9ALDH1A1ALDH2
SCHEMBL20527532 0.90 CA12 (0.50) CA12CA1CA9ALDH1A1ALDH2
SCHEMBL667939 0.90 CA12 (0.50) CA12CA1CA9ALDH1A1ALDH2
SCHEMBL20527611 0.90 CA12 (0.48) CA12CA1CA9ALDH1A1ALDH2
Hydrochloric Acid SCHEMBL11894016 0.88 CA12 (0.48) CA12CA1CA9ALDH1A1ALDH2
Hydrochloric Acid SCHEMBL11894281 0.88 CA12 (0.48) CA12CA1CA9ALDH1A1ALDH2
SCHEMBL1713412 0.88 CA12 (0.40) CA12CA1CA9ALDH1A1ALDH2
Hydrochloric Acid SCHEMBL25406791 0.86 CA12 (0.39) CA12CA1CA9ALDH1A1ALDH2
Bromide SCHEMBL1535791 0.86 CA12 (0.39) CA12CA1CA9ALDH1A1ALDH2
SCHEMBL17363406 0.86 CA12 (0.39) CA12CA1CA9ALDH1A1ALDH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11377535-B2 Carbon fiber recovery compositions and methods THE BOEING COMPANY (US) 2022-07-05 US claimed
US-20200207940-A1 Carbon Fiber Recovery Compositions and Methods THE BOEING COMPANY 2020-07-02 US claimed
US-10611892-B2 Carbon fiber recovery compositions and methods THE BOEING COMPANY (US) 2020-04-07 US claimed
US-20180291174-A1 Carbon Fiber Recovery Compositions and Methods THE BOEING COMPANY 2018-10-11 US claimed
US-11377535-B2 Carbon fiber recovery compositions and methods THE BOEING COMPANY (US) 2022-07-05 US disclosed
US-20200207940-A1 Carbon Fiber Recovery Compositions and Methods THE BOEING COMPANY 2020-07-02 US disclosed
US-10611892-B2 Carbon fiber recovery compositions and methods THE BOEING COMPANY (US) 2020-04-07 US disclosed
US-20180291174-A1 Carbon Fiber Recovery Compositions and Methods THE BOEING COMPANY 2018-10-11 US disclosed