SCHEMBL29705104

SCHEMBL29705104

CCOC(=O)c1cn(CCN(C)C(=O)OC(C)(C)C)c2ncc(B(O)O)cc2c1=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
ALDH1A1 P00352 5/20 0.35
KMT2A Q03164 3/20 0.35
CYP1A2 P05177 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
KDM4E B2RXH2 4/20 0.33
HPGD P15428 4/20 0.33
HSD17B10 Q99714 3/20 0.33
POLB P06746 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
MAPK1 P28482 2/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
SMN1; SMN2 Q16637 3/20 0.32
RXFP1 Q9HBX9 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
HTT P42858 1/20 0.32

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
SCHEMBL20521317 1.00 LMNA (0.36) LMNAALDH1A1KMT2ACYP1A2TDP1
SCHEMBL20240770 0.88 LMNA (0.46) LMNAALDH1A1KMT2ACYP1A2TDP1
SCHEMBL29705130 0.87 CYP1A2 (0.42) LMNAALDH1A1KMT2ACYP1A2TDP1
SCHEMBL20556271 0.87 CYP1A2 (0.42) LMNAALDH1A1KMT2ACYP1A2TDP1
SCHEMBL29705136 0.85 LMNA (0.42) LMNAALDH1A1KMT2ACYP1A2TDP1
SCHEMBL20522214 0.85 LMNA (0.42) LMNAALDH1A1KMT2ACYP1A2TDP1
SCHEMBL20521183 0.84 KDM4E (0.35) LMNAALDH1A1KMT2ACYP1A2KDM4E
SCHEMBL29705146 0.84 KDM4E (0.35) LMNAALDH1A1KMT2ACYP1A2KDM4E
SCHEMBL20521007 0.82 LMNA (0.39) LMNAALDH1A1KMT2ACYP1A2TDP1
SCHEMBL29705126 0.82 LMNA (0.39) LMNAALDH1A1KMT2ACYP1A2TDP1

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
CN-110475777-B Novel pyrido [2,3-b ] indole compounds for the treatment and prevention of bacterial infections 豪夫迈·罗氏有限公司 2022-04-15 CN disclosed