SCHEMBL28051206

SCHEMBL28051206

CCC(CCN)(CCO)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP1A2 P05177 1/20 0.36
THRB P10828 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
ARG1 P05089 2/20 0.32
ARG2 P78540 2/20 0.32
ODC1 P11926 2/20 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
SCHEMBL692369 0.91 CYP4F2 (0.41) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL8571461 0.86 CYP4F2 (0.41) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL9560658 0.86 MEN1 (0.41) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL11416969 0.83 CYP4F2 (0.53) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL2123448 0.82 CYP4F2 (0.38) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL17451110 0.81 CYP4F2 (0.43) MEN1ALDH1A1KMT2ACYP4F2CYP4A11
SCHEMBL5795368 0.81 ALDH1A1 (0.48) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL48924 0.78 CYP2D6 (0.39) MEN1ALDH1A1CYP1A2THRBKMT2A
SCHEMBL7039429 0.78 CYP4F2 (0.44) MEN1ALDH1A1KMT2ACYP4F2CYP4A11
SCHEMBL3845068 0.78 CYP4F2 (0.44) MEN1ALDH1A1KMT2ACYP4F2CYP4A11

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-103820019-B Aqueous polyurethane Stripable paint and preparation method thereof SERVTEK MATERIAL TECHNOLOGY CO., LTD. (CN) 2016-02-17 CN disclosed