SCHEMBL1050592

SCHEMBL1050592

COCCOc1cccc2ccc(CBr)cc12

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.44
HTR1B P28222 12/20 0.42
HTR1D P28221 3/20 0.42
SLC6A4 P31645 2/20 0.40
HRH1 P35367 1/20 0.40
KCNA3 P22001 1/20 0.39

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
SCHEMBL27675079 0.89 KDM1A (0.43) KDM1AHTR1BHTR1DSLC6A4HRH1
SCHEMBL1051243 0.85 KDM1A (0.44) KDM1AHTR1BHTR1DSLC6A4HRH1
SCHEMBL1049210 0.83 KDM1A (0.39) KDM1AHTR1BHTR1DSLC6A4HRH1
SCHEMBL27655325 0.81 AKR1B1 (0.47) KDM1A
SCHEMBL27675055 0.79 HTR1B (0.38) KDM1AHTR1BHTR1DSLC6A4HRH1
SCHEMBL1049417 0.78 MMP1 (0.40) KDM1AHTR1BHTR1DSLC6A4HRH1
SCHEMBL30007810 0.77 HTR1B (0.65) KDM1AHTR1BHTR1DSLC6A4HRH1
SCHEMBL667918 0.77 HTR1B (0.65) KDM1AHTR1BHTR1DSLC6A4HRH1
SCHEMBL30359494 0.76 NCF1 (0.49) KDM1AHTR1BHTR1D
SCHEMBL9466089 0.76 KDM1A (0.49) KDM1AHTR1BHTR1DSLC6A4HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7868036-B2 Organic compounds NOVARTIS AG (CH) 2011-01-11 US disclosed
US-20080058320-A1 Organic Compounds NOVARTIS AG (CH) 2008-03-06 US disclosed
EP-1725530-A1 ORGANIC COMPOUNDS Speedel Experimenta AG (CH) 2006-11-29 EP disclosed
WO-2005090304-A1 ORGANIC COMPOUNDS SPEEDEL EXPERIMENTA AG (CH) 2005-09-29 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-20080058320-A1 Organic Compounds REN, AGTR1, ADH1C KDM1A 1849/4885HTR1B 517/4885HTR1D 698/4885

“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.