SCHEMBL30282852

SCHEMBL30282852

CCCCCc1cc2cc(C)ccc2n1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 2/20 0.44
▸ MAPT P10636 3/20 0.44
▸ RXFP1 Q9HBX9 2/20 0.44
▸ GPR84 Q9NQS5 1/20 0.42
▸ PPARG P37231 1/20 0.40
▸ PPARA Q07869 1/20 0.40
▸ LMNA P02545 2/20 0.39
▸ TP53 P04637 2/20 0.39
▸ THRB P10828 1/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ PGR P06401 1/20 0.38
▸ RORA P35398 1/20 0.38
▸ RORC P51449 1/20 0.38
▸ RORB Q92753 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL28283584 0.83 BRPF1 (0.46) TLR8MAPTGPR84MEN1KMT2A
SCHEMBL28870713 0.81 BRPF1 (0.45) TLR8MAPTGPR84MEN1KMT2A
SCHEMBL287263 0.81 OXER1 (0.54) GPR84OXER1
SCHEMBL3699735 0.81 OXER1 (0.54) GPR84OXER1
SCHEMBL16452837 0.81 MAPT (0.50) MAPTRXFP1LMNATP53THRB
SCHEMBL28932571 0.80 DHFR (0.45) TLR8PPARGPPARATP53MEN1
SCHEMBL28223276 0.80 OXER1 (0.53) OXER1
SCHEMBL1315631 0.79 HTR2A (0.42) TLR8GPR84LMNATP53MEN1
SCHEMBL3696937 0.79 OXER1 (0.54) GPR84OXER1
SCHEMBL18407425 0.78 GPR84 (0.47) TLR8MAPTGPR84MEN1KMT2A

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-113717091-B Indole derivatives and preparation method and application thereof 南京医科大学 2023-03-10 — — CN disclosed
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