SCHEMBL5250848

SCHEMBL5250848

Brc1ccc(-c2c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c(-c3ccccc3)c2-c2ccc(Br)cc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.78
MAPK1 P28482 2/20 0.78
TDP1 Q9NUW8 1/20 0.56
NPC1 O15118 1/20 0.52
NFKB1 P19838 1/20 0.52
RAB9A P51151 1/20 0.52
NFKB2 Q00653 1/20 0.52
RELA Q04206 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
MAPK13 O15264 3/20 0.48
GCGR P47871 3/20 0.48
MAPK12 P53778 3/20 0.48
MAPK11 Q15759 3/20 0.48
MAPK14 Q16539 3/20 0.48
NR1H4 Q96RI1 1/20 0.48
CYP2A6 P11509 1/20 0.47
MAPT P10636 2/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
DGAT1 O75907 1/20 0.45

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
SCHEMBL10019513 1.00 ALDH1A1 (0.78) ALDH1A1MAPK1TDP1NPC1NFKB1
SCHEMBL5804045 1.00 ALDH1A1 (0.78) ALDH1A1MAPK1TDP1NPC1NFKB1
SCHEMBL13777185 0.90 MAPK1 (0.64) ALDH1A1MAPK1TDP1NPC1NFKB1
SCHEMBL13777184 0.90 MAPK1 (0.64) ALDH1A1MAPK1TDP1NPC1NFKB1
SCHEMBL22143498 0.88 ALDH1A1 (0.61) ALDH1A1MAPK1TDP1NPC1NFKB1
SCHEMBL22143642 0.88 ALDH1A1 (0.61) ALDH1A1MAPK1TDP1NPC1NFKB1
SCHEMBL22143646 0.88 ALDH1A1 (0.61) ALDH1A1MAPK1TDP1NPC1NFKB1
SCHEMBL22143503 0.88 ALDH1A1 (0.61) ALDH1A1MAPK1TDP1NPC1NFKB1
SCHEMBL20160809 0.88 ALDH1A1 (0.61) ALDH1A1MAPK1TDP1NPC1NFKB1
SCHEMBL22143499 0.88 ALDH1A1 (0.61) ALDH1A1MAPK1TDP1NPC1NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150126773-A1 USE OF SOLUTIONS OF SYNTHETIC ALKYLATED GRAPHENES SOLUTIONS FOR MULTIPHASE FLOW TEST FLUIDS TO BE USED BY THE OIL AND GAS INDUSTRY SINVENT AS (NO) 2015-05-07 US disclosed
US-20150126773-A1 USE OF SOLUTIONS OF SYNTHETIC ALKYLATED GRAPHENES SOLUTIONS FOR MULTIPHASE FLOW TEST FLUIDS TO BE USED BY THE OIL AND GAS INDUSTRY SINVENT AS (NO) 2015-05-07 US disclosed
US-20150126773-A1 USE OF SOLUTIONS OF SYNTHETIC ALKYLATED GRAPHENES SOLUTIONS FOR MULTIPHASE FLOW TEST FLUIDS TO BE USED BY THE OIL AND GAS INDUSTRY SINVENT AS (NO) 2015-05-07 US disclosed
EP-1123337-B1 CONJUGATED POLYMERS CONTAINING 2,7 FLUORENYL UNITS WITH IMPROVED PROPERTIES MERCK PATENT GMBH (DE) 2007-09-26 EP disclosed
US-6541602-B1 Electroluminescent device containing a polyfluorene aromatic monomer, coupling through ring to a mono or polycyclic aromatic conjugated monomer having 5-20 carbon atoms CELANESE VENTURES GMBH (DE) 2003-04-01 US disclosed
EP-1123337-A1 CONJUGATED POLYMERS CONTAINING 2,7 FLUORENYL UNITS WITH IMPROVED PROPERTIES Celanese Ventures GmbH (DE) 2001-08-16 EP disclosed
WO-2000022027-A1 CONJUGATED POLYMERS CONTAINING 2,7 FLUORENYL UNITS WITH IMPROVED PROPERTIES CELANESE VENTURES GMBH (DE) 2000-04-20 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-20150126773-A1 USE OF SOLUTIONS OF SYNTHETIC ALKYLATED GRAPHENES SOLUTIONS FOR MULTIPHASE FLOW TEST FLUIDS TO BE USED BY THE OIL AND GAS INDUSTRY AGPAT2, LCAT, ARNT ALDH1A1 2527/4885MAPK1 2784/4885TDP1 2774/4885

“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.