SCHEMBL23398497

SCHEMBL23398497

CCn1nc(O)c(-c2ccc(C)cc2)c1C(C)C

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GCGR P47871 1/20 0.37
USP7 Q93009 1/20 0.35
MAPT P10636 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
HEXA P06865 1/20 0.32
HEXB P07686 1/20 0.32
ACHE P22303 1/20 0.31
KMT2A Q03164 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MEN1 O00255 1/20 0.31
CNR1 P21554 1/20 0.31
TRPM8 Q7Z2W7 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
SCHEMBL23403418 0.88 ESR1 (0.39) GCGRUSP7MAPTSMN1; SMN2KDM4E
SCHEMBL23401896 0.87 GCGR (0.34) GCGRUSP7MAPTALDH1A1ACHE
SCHEMBL23399209 0.86 GCGR (0.39) GCGRUSP7SMN1; SMN2KDM4EALDH1A1
SCHEMBL23399501 0.86 GCGR (0.42) GCGRSMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL23403338 0.81 LMNA (0.41) USP7MAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL23403589 0.80 MAPT (0.41) GCGRUSP7MAPTSMN1; SMN2KDM4E
SCHEMBL23402959 0.80 GCGR (0.37) GCGRUSP7MAPTALDH1A1ACHE
SCHEMBL23401897 0.79 RAB9A (0.38) MAPTSMN1; SMN2KDM4EALDH1A1KMT2A
SCHEMBL23401888 0.78 GRIA2 (0.40) USP7MAPTSMN1; SMN2KDM4EALDH1A1
SCHEMBL23400454 0.78 HTR2B (0.37) GCGRUSP7KDM4EALDH1A1LMNA

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