SCHEMBL10356771

SCHEMBL10356771

COc1cc(-c2cc(OC)c(Cl)cc2OC)c(OC)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.54
▸ NPC1 O15118 1/20 0.54
▸ TAAR1 Q96RJ0 1/20 0.50
▸ HSP90AA1 P07900 3/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ PKM P14618 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ CCR6 P51684 1/20 0.47
▸ CACNA1B Q00975 1/20 0.47
▸ APBA1 Q02410 1/20 0.47
▸ APOBEC3G Q9HC16 1/20 0.47
▸ HSP90AB1 P08238 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ POLB P06746 1/20 0.41
▸ PGK1 P00558 1/20 0.40
▸ GSK3B P49841 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
Chloroneb SCHEMBL22739 0.89 GAA (0.64) GAANPC1TAAR1HSP90AA1ALDH1A1
SCHEMBL12458505 0.84 GAA (0.41) GAANPC1TAAR1HSP90AA1ALDH1A1
SCHEMBL30487990 0.83 GAA (0.65) GAANPC1TAAR1HSP90AA1ALDH1A1
SCHEMBL27952777 0.83 GAA (0.65) GAANPC1TAAR1HSP90AA1ALDH1A1
SCHEMBL3757554 0.83 NPC1 (0.65) GAANPC1TAAR1HSP90AA1ALDH1A1
SCHEMBL16609990 0.80 GAA (0.68) GAANPC1TAAR1HSP90AA1ALDH1A1
SCHEMBL9732658 0.80 MAPK1 (0.57) GAANPC1TAAR1HSP90AA1ALDH1A1
SCHEMBL19709407 0.80 GAA (0.50) GAANPC1TAAR1HSP90AA1ALDH1A1
SCHEMBL9732232 0.80 AHR (0.57) GAANPC1TAAR1HSP90AA1ALDH1A1
SCHEMBL7897846 0.80 MAPK1 (0.57) GAANPC1TAAR1HSP90AA1ALDH1A1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8378340-B2 Aromatic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-02-19 — — US disclosed
US-20120238765-A1 AROMATIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-20 — — US disclosed
US-8222426-B2 Aromatic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-17 — — US disclosed
US-8222426-B2 Aromatic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-17 — — US disclosed
US-7842941-B2 Aromatic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-30 — — US disclosed
US-7842941-B2 Aromatic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-30 — — US disclosed
US-20100256396-A1 AROMATIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-10-07 — — US disclosed
US-20100256396-A1 AROMATIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-10-07 — — US disclosed
EP-1344788-B1 Conjugated polymer comprising dibenzothiophene- or dibenzofuran-units and their use in polymer LEDs SUMITOMO CHEMICAL CO (JP) 2010-06-23 — — EP disclosed
EP-2107076-A1 Conjugated polymer comprising dibenzothiophene- or dibenzofuran-units and their use in polymer LEDs Sumitomo Chemical Company, Limited (JP) 2009-10-07 — — EP disclosed
US-7208567-B2 Polymer compound and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-24 — — US disclosed
US-7208567-B2 Polymer compound and polymer light emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-04-24 — — US disclosed
US-20070063190-A1 Aromatic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-03-22 — — US disclosed
US-20070063190-A1 Aromatic compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-03-22 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100256396-A1 AROMATIC COMPOUND AHR, AR, NR0B1 GAA 3755/4885NPC1 1904/4885TAAR1 428/4885
US-20070063190-A1 Aromatic compound AHR, AR, NR0B1 GAA 3738/4885NPC1 1826/4885TAAR1 461/4885
US-20120238765-A1 AROMATIC COMPOUND AHR, AR, NR0B1 GAA 3755/4885NPC1 1904/4885TAAR1 428/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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