SCHEMBL23401893

SCHEMBL23401893

CCn1nc(O)c(CC(C)C)c1-c1ccc(C)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.37
DPP4 P27487 6/20 0.33
DPP8 Q6V1X1 2/20 0.33
DPP9 Q86TI2 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
NPC1 O15118 1/20 0.31
CYP2C19 P33261 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
KDM4E B2RXH2 2/20 0.31
HSD17B10 Q99714 2/20 0.31
GCGR P47871 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 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
SCHEMBL23401589 0.89 ESR1 (0.34) MAPTDPP4DPP8DPP9MEN1
SCHEMBL23403302 0.89 DPP4 (0.33) MAPTDPP4DPP8DPP9MEN1
SCHEMBL23399770 0.87 HTR2A (0.42) MAPTMEN1KMT2AHTR2AHTR2C
SCHEMBL23403710 0.87 GCGR (0.36) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL23401906 0.85 MAPT (0.40) MAPTKMT2AHTR2AHTR2CHTR2B
SCHEMBL23401902 0.84 NPC1 (0.41) MAPTDPP4MEN1KMT2AHTR2C
SCHEMBL23402248 0.82 MAPT (0.35) MAPTDPP4DPP8DPP9MEN1
SCHEMBL23398551 0.82 MAPT (0.43) MAPTDPP4MEN1KMT2AHTR2A
SCHEMBL23401349 0.81 HTR2A (0.43) MAPTDPP4DPP8DPP9MEN1
SCHEMBL23399315 0.81 ADORA3 (0.39) MAPTDPP4MEN1KMT2AHPGD

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
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 EP disclosed