SCHEMBL57643

SCHEMBL57643

Cc1c(C)c2cc(Br)ccc2c2ccc(Br)cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 2/20 0.46
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 2/20 0.40
KMT2A Q03164 1/20 0.39
KIT P10721 1/20 0.38
CYP2A6 P11509 2/20 0.37
JAK2 O60674 3/20 0.37
METAP2 P50579 1/20 0.37
CHEK1 O14757 1/20 0.37
AURKA O14965 1/20 0.37
DAPK3 O43293 1/20 0.37
PRKD3 O94806 1/20 0.37
MAP4K4 O95819 1/20 0.37
PAK4 O96013 1/20 0.37
ABL1 P00519 1/20 0.37
NTRK1 P04629 1/20 0.37
CSF1R P07333 1/20 0.37
RET P07949 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
SCHEMBL19757717 0.91 ESR2 (0.41) ESR2ALDH1A1LMNAHPGDMAPK1
SCHEMBL28276718 0.91 ALDH1A1 (0.46) ESR2ALDH1A1LMNAHPGDMAPK1
SCHEMBL14099591 0.89 ESR2 (0.42) ESR2ALDH1A1LMNAHPGDMAPK1
SCHEMBL3744740 0.89 ESR2 (0.42) ESR2ALDH1A1LMNAHPGDMAPK1
SCHEMBL28583244 0.85 KMT2A (0.44) ESR2ALDH1A1LMNAHPGDMAPK1
SCHEMBL19713318 0.82 MAPK1 (0.43) ESR2ALDH1A1LMNAHPGDMAPK1
SCHEMBL16158369 0.82 CYP2A6 (0.47) ESR2ALDH1A1MAPK1KMT2ACYP2A6
SCHEMBL28583249 0.79 ALDH1A1 (0.47) ESR2ALDH1A1MAPK1KMT2AJAK2
SCHEMBL18481324 0.77 ALDH1A1 (0.50) ESR2ALDH1A1KMT2AAURKAKDR
SCHEMBL13616030 0.77 BCL2 (0.45) ESR2ALDH1A1MAPK1KMT2ACYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3287506-B1 PHENANTHRENE DERIVATIVES MERCK PATENT GMBH (DE) 2020-02-26 EP disclosed
EP-1797158-B1 PHENANTHRENE DERIVATIVES MERCK PATENT GMBH (DE) 2019-05-01 EP disclosed
US-9966534-B2 Polymer and device CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2018-05-08 US disclosed
EP-3287506-A1 PHENANTHRENE DERIVATIVES Merck Patent GmbH (DE) 2018-02-28 EP disclosed
US-20150333262-A1 POLYMER AND DEVICE CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2015-11-19 US disclosed
US-8129037-B2 Phenanthrene derivative MERCK PATENT GMBH (DE) 2012-03-06 US disclosed
US-7947382-B2 Electroluminescent polymers and the use thereof MERCK PATENT GMBH (DE) 2011-05-24 US disclosed
US-7947382-B2 Electroluminescent polymers and the use thereof MERCK PATENT GMBH (DE) 2011-05-24 US disclosed
US-7947382-B2 Electroluminescent polymers and the use thereof MERCK PATENT GMBH (DE) 2011-05-24 US disclosed
US-20090026919-A1 PHENANTHRENE DERIVATIVE MERCK PATEN GMBH PATENTS & SCIENTIFIC INFORMATION (DE) 2009-01-29 US disclosed
EP-1741149-B1 ELECTROLUMINESCENT POLYMERS AND USE THEROF MERCK PATENT GMBH (DE) 2008-12-24 EP disclosed
EP-1741149-B1 ELECTROLUMINESCENT POLYMERS AND USE THEROF MERCK PATENT GMBH (DE) 2008-12-24 EP disclosed
US-20070205714-A1 Electroluminescent Polymers and the Use Thereof MERCK PATENT GMBH (DE) 2007-09-06 US disclosed
US-20070205714-A1 Electroluminescent Polymers and the Use Thereof MERCK PATENT GMBH (DE) 2007-09-06 US disclosed
US-20070205714-A1 Electroluminescent Polymers and the Use Thereof MERCK PATENT GMBH (DE) 2007-09-06 US disclosed
EP-1797158-A1 PHENANTHRENE DERIVATIVE Merck Patent GmbH (DE) 2007-06-20 EP disclosed
EP-1741149-A1 ELECTROLUMINESCENT POLYMERS AND USE THEROF MERCK PATENT GmbH (DE) 2007-01-10 EP disclosed
WO-2006039982-A1 PHENANTHRENE DERIVATIVE MERCK PATENT GMBH (DE) 2006-04-20 WO disclosed
EP-1645610-A1 Phenanthrene derivatives Covion Organic Semiconductors GmbH (DE) 2006-04-12 EP disclosed
WO-2005104264-A1 ELECTROLUMINESCENT POLYMERS AND USE THEROF MERCK PATENT GMBH (DE) 2005-11-03 WO 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 (1 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-20090026919-A1 PHENANTHRENE DERIVATIVE LEF1, CRY1, WNT1 ESR2 113/4885ALDH1A1 262/4885LMNA 1767/4885

“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.