SCHEMBL28149697

SCHEMBL28149697

CCCCC(C)CCCCN=C=O

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.40
NAAA Q02083 1/20 0.38
LMNA P02545 1/20 0.34
OPRM1 P35372 1/20 0.32
CA1 P00915 2/20 0.31
MAPT P10636 2/20 0.31
TP53 P04637 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
SCHEMBL11615998 0.94 ACE2 (0.47) ACE2NAAAOPRM1CA1MAPT
SCHEMBL28303059 0.94 ACE2 (0.37) ACE2NAAALMNAMAPT
SCHEMBL999994 0.92 LMNA (0.40) ACE2LMNA
SCHEMBL4457453 0.90 LMNA (0.39) ACE2LMNA
SCHEMBL5841490 0.88 LMNA (0.37) ACE2LMNA
SCHEMBL10316530 0.86 LMNA (0.36) ACE2NAAALMNA
SCHEMBL10456184 0.86 LMNA (0.31) NAAALMNA
SCHEMBL11660910 0.85 LMNA (0.36) LMNA
SCHEMBL28403399 0.83 LMNA (0.40) ACE2LMNA
SCHEMBL29024394 0.82 CA2 (0.43) NAAALMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106893069-A The carbamate polybutadiene of acrylate ended 赢创德固赛有限公司 2017-06-27 CN disclosed
CN-103080269-A Photochromic composition TOKUYAMA CORP 2013-05-01 CN disclosed