SCHEMBL24317766

SCHEMBL24317766

CCOc1ccc(Cc2ccc3c4c(cccc24)N(C(C=O)CCC(=O)NC)C3=O)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ACACB O00763 3/20 0.33
SYK P43405 1/20 0.32
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
FFAR1 O14842 7/20 0.31
PPARD Q03181 3/20 0.31
FFAR4 Q5NUL3 1/20 0.31
PTGS2 P35354 1/20 0.31
TP53 P04637 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
KLKB1 P03952 1/20 0.31
MAOB P27338 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KDM4E B2RXH2 1/20 0.31
RORC P51449 1/20 0.30

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
SCHEMBL24317938 0.79 ALDH1A1 (0.39) MAPTNPSR1TP53RXFP1ALDH1A1
SCHEMBL24316240 0.76 CYP1B1 (0.41) MAPTHDAC6TP53RXFP1ALDH1A1
SCHEMBL24317614 0.71 TDP1 (0.46) MAPTTP53ALDH1A1KDM4E
SCHEMBL24315752 0.71 HDAC8 (0.40) KDM4E
SCHEMBL24315912 0.71 KDM4E (0.34) MAPTALDH1A1KDM4E
SCHEMBL24315949 0.70 KDM4E (0.32) KDM4E
SCHEMBL29531821 0.68 CRBN (0.49) ALDH1A1
SCHEMBL24317765 0.68 CRBN (0.49) ALDH1A1
SCHEMBL24316089 0.68 MAPT (0.41) MAPTNPSR1HDAC6ALDH1A1
SCHEMBL24317645 0.67 MAPT (0.48) MAPTALDH1A1KDM4ERORC

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
WO-2022081927-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C4 THERAPEUTICS, INC. (US) 2022-04-21 WO disclosed