SCHEMBL10935810

SCHEMBL10935810

CCCCOc1ccc(-c2ccc3c(c2O)C(=O)c2cc(Cl)cc(O)c2C3=O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 1/20 0.46
▸ MAOB P27338 1/20 0.46
▸ NPC1 O15118 2/20 0.45
▸ RAB9A P51151 2/20 0.45
▸ MEN1 O00255 2/20 0.45
▸ GAA P10253 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ ELANE P08246 3/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ HSP90AA1 P07900 1/20 0.42
▸ MCL1 Q07820 1/20 0.41
▸ ACLY P53396 1/20 0.40
▸ PTPN11 Q06124 1/20 0.40
▸ FFAR1 O14842 1/20 0.40
▸ FFAR4 Q5NUL3 1/20 0.40
▸ CTSG P08311 2/20 0.39

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
SCHEMBL10936375 0.98 GPR84 (0.44) GPR84MAOBNPC1RAB9AMEN1
SCHEMBL10938731 0.97 PTPN11 (0.45) GPR84MAOBNPC1RAB9AMEN1
SCHEMBL10937135 0.97 PTPN11 (0.45) GPR84MAOBNPC1RAB9AMEN1
SCHEMBL10936230 0.97 PTPN11 (0.45) GPR84MAOBNPC1RAB9AMEN1
SCHEMBL10937539 0.95 MAOB (0.51) GPR84MAOBNPC1RAB9AMEN1
SCHEMBL10937940 0.90 KMT2A (0.45) MAOBMEN1GAAKMT2AALDH1A1
SCHEMBL10934578 0.85 NPC1 (0.46) GPR84MAOBNPC1RAB9AMEN1
SCHEMBL11120685 0.85 NR5A1 (0.53) GPR84NPC1RAB9AMEN1GAA
SCHEMBL10937755 0.84 ACLY (0.56) MEN1GAAKMT2AALDH1A1MAPT
SCHEMBL10937359 0.83 NR5A1 (0.46) GPR84NPC1RAB9AMEN1GAA

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
US-4532069-A For electro-optical display elements MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1985-07-30 — — US disclosed
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