SCHEMBL30701355

SCHEMBL30701355

NC(=O)CCCCCCCCCCN1CCSCC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
PAOX Q6QHF9 2/20 0.46
ARG1 P05089 1/20 0.41
ARG2 P78540 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
CYP1A2 P05177 1/20 0.37
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
KMT2A Q03164 1/20 0.36
TARDBP Q13148 1/20 0.36
HTR7 P34969 5/20 0.36
KDM1A O60341 1/20 0.35
BCHE P06276 1/20 0.34

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
SCHEMBL29973401 0.92 L3MBTL1 (0.50) L3MBTL1PAOXARG1ARG2ALDH1A1
SCHEMBL2911096 0.86 L3MBTL1 (0.63) L3MBTL1ARG1ARG2ALDH1A1MAPT
SCHEMBL11739723 0.85 CYP1A2 (0.55) PAOXARG1ARG2ALDH1A1MAPT
SCHEMBL27033191 0.85 CYP1A2 (0.55) PAOXARG1ARG2ALDH1A1MAPT
SCHEMBL5507736 0.82 L3MBTL1 (0.69) L3MBTL1PAOXALDH1A1MAPTALOX15
SCHEMBL10624598 0.82 L3MBTL1 (0.69) L3MBTL1PAOXALDH1A1MAPTALOX15
SCHEMBL30701387 0.82 L3MBTL1 (0.69) L3MBTL1PAOXALDH1A1MAPTALOX15
SCHEMBL5500455 0.82 L3MBTL1 (0.69) L3MBTL1PAOXALDH1A1MAPTALOX15
SCHEMBL5506643 0.80 L3MBTL1 (0.73) L3MBTL1PAOXALDH1A1MAPTALOX15
SCHEMBL16395702 0.80 L3MBTL1 (0.73) L3MBTL1PAOXALDH1A1MAPTALOX15

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-117222414-A Compounds for activating constant natural killer T-cells and methods for eliminating inflammatory senescent cells 脱落性治疗公司 2023-12-12 CN disclosed