SCHEMBL3164785

SCHEMBL3164785

O=C(c1cc(Br)cc(Br)c1)c1ccc(Br)[nH]1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ HTT P42858 2/20 0.33
▸ ALOX15 P16050 2/20 0.33
▸ HPGD P15428 2/20 0.32
▸ CES2 O00748 1/20 0.31
▸ CES1 P23141 1/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ CTSL P07711 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
SCHEMBL3164502 0.81 HTT (0.36) PARP1LMNAALDH1A1TP53HTT
SCHEMBL9792276 0.78 ALDH1A1 (0.50) LMNAALDH1A1HTTALOX15CES2
SCHEMBL9792285 0.76 KMT2A (0.48) ALDH1A1HTTALOX15HPGDCES2
SCHEMBL1168105 0.73 HTT (0.43) PARP1LMNAALDH1A1HTTALOX15
SCHEMBL3174176 0.72 CYP2D6 (0.45) HTTALOX15RAB9AMEN1NPC1
SCHEMBL6133148 0.72 ALDH1A1 (0.40) ALDH1A1HTTRAB9AMEN1NPC1
SCHEMBL10848882 0.70 — —
SCHEMBL428172 0.69 — —
SCHEMBL27967553 0.68 PLG (0.37) HTTMEN1KMT2A
SCHEMBL8305175 0.68 LMNA (0.70) LMNAALDH1A1HTTALOX15HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7718277-B2 Electronic devices comprising organic iridium compositions GENERAL ELECTRIC COMPANY (US) 2010-05-18 — — US disclosed
US-7718087-B2 Organic iridium compositions and their use in electronic devices GENERAL ELECTRIC COMPANY (US) 2010-05-18 — — US disclosed
US-7704610-B2 organic light emitting device comprising deuterated organic iridium complex; optoelectronic devices, photovoltaic devices; enhanced color properties and light output efficiencies GENERAL ELECTRIC COMPANY (US) 2010-04-27 — — US disclosed
US-20100090586-A1 ELECTRONIC DEVICES COMPRISING ORGANIC IRIDIUM COMPOSITIONS GENERAL ELECTRIC COMPANY 2010-04-15 — — US disclosed
US-7695640-B2 Organic iridium compositions and their use in electronic devices GENERAL ELECTRIC COMPANY (US) 2010-04-13 — — US disclosed
US-7691292-B2 organic light emitters; photovoltaic cells; electrophosphorescent GENERAL ELECTRIC COMPANY (US) 2010-04-06 — — US disclosed
US-7691494-B2 Electronic devices comprising organic iridium compositions GENERAL ELECTRIC COMPANY (US) 2010-04-06 — — US disclosed
US-20100051869-A1 ORGANIC IRIDIUM COMPOSITIONS AND THEIR USE IN ELECTRONIC DEVICES GENERAL ELECTRIC COMPANY 2010-03-04 — — US disclosed
US-7652151-B2 Ketopyrroles useful as ligands in organic iridium compositions GENERAL ELECTRIC COMPANY (US) 2010-01-26 — — US disclosed
US-7608677-B2 Method for preparing polymeric organic iridium compositions GENERAL ELECTRIC COMPANY (US) 2009-10-27 — — US disclosed
EP-2049555-A2 ORGANIC IRIDIUM COMPOSITIONS AND THEIR USE IN ELECTRONIC DEVICES GENERAL ELECTRIC COMPANY (US) 2009-04-22 — — EP disclosed
US-20080023672-A1 Organic iridium compositions and their use in electronic devices GENERAL ELECTRIC COMPANY 2008-01-31 — — US disclosed
US-20080026249-A1 Electronic devices comprising organic iridium compositions GENERAL ELECTRIC COMPANY 2008-01-31 — — US disclosed
US-20080023671-A1 Organic iridium compositions and their use in electronic devices GENERAL ELECTRIC COMPANY 2008-01-31 — — US disclosed
US-20080026250-A1 Electronic devices comprising organic iridium compositions GENERAL ELECTRIC COMPANY 2008-01-31 — — US disclosed
US-20080027028-A1 Ketopyrroles useful as ligands in organic iridium compositions GENERAL ELECTRIC COMPANY 2008-01-31 — — US disclosed
WO-2008014037-A2 ORGANIC IRIDIUM COMPOSITIONS AND THEIR USE IN ELECTRONIC DEVICES GENERAL ELECTRIC COMPANY (US) 2008-01-31 — — WO disclosed
US-20080026477-A1 Method for preparing polymeric organic iridium compositions GENERAL ELECTRIC COMPANY (US) 2008-01-31 — — 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 (2 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-20080027028-A1 Ketopyrroles useful as ligands in organic iridium compositions OR10J3, OPRD1, OCIAD1 PARP1 1003/4885LMNA 4454/4885ALDH1A1 2880/4885
US-20100051869-A1 ORGANIC IRIDIUM COMPOSITIONS AND THEIR USE IN ELECTRONIC DEVICES OCIAD1, OCIAD2, OXER1 PARP1 2155/4885LMNA 4875/4885ALDH1A1 359/4885

“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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