SCHEMBL10936375

SCHEMBL10936375

CCCCCOc1ccc(-c2ccc3c(c2O)C(=O)c2cc(Cl)cc(O)c2C3=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 1/20 0.44
▸ MAOB P27338 1/20 0.44
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PTPN11 Q06124 2/20 0.43
▸ NR5A1 Q13285 1/20 0.42
▸ RARB P10826 3/20 0.41
▸ ALDH2 P05091 1/20 0.41
▸ ELANE P08246 2/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ LTA4H P09960 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.40

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
SCHEMBL10936230 0.99 PTPN11 (0.45) GPR84MAOBNPC1RAB9AMEN1
SCHEMBL10938731 0.99 PTPN11 (0.45) GPR84MAOBNPC1RAB9AMEN1
SCHEMBL10937135 0.99 PTPN11 (0.45) GPR84MAOBNPC1RAB9AMEN1
SCHEMBL10935810 0.98 GPR84 (0.46) GPR84MAOBNPC1RAB9AMEN1
SCHEMBL10937539 0.93 MAOB (0.51) GPR84MAOBNPC1RAB9AMEN1
SCHEMBL10937940 0.88 KMT2A (0.45) MAOBMEN1ALDH1A1GAAMAPT
SCHEMBL11120685 0.88 NR5A1 (0.53) GPR84NPC1RAB9AMEN1ALDH1A1
SCHEMBL10937359 0.86 NR5A1 (0.46) GPR84NPC1RAB9AMEN1ALDH1A1
SCHEMBL10936357 0.85 NR5A1 (0.48) GPR84NPC1RAB9AMEN1ALDH1A1
SCHEMBL10934038 0.85 NR5A1 (0.48) GPR84NPC1RAB9AMEN1ALDH1A1

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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