SCHEMBL5675008

SCHEMBL5675008

Cc1cc(Br)cc2c1NCC2C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 7/20 0.40
HTR2A P28223 5/20 0.40
HTR2B P41595 5/20 0.40
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
HTR1D P28221 2/20 0.33
HTR1B P28222 2/20 0.33
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
MAPKAPK2 P49137 1/20 0.31

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
SCHEMBL20865831 0.80 HTR2A (0.39) HTR2CHTR2AHTR2BCA1CA2
SCHEMBL31607544 0.78 HTR2C (0.40) HTR2CHTR2AHTR2BCA1CA2
SCHEMBL5673495 0.77 HTR2C (0.34) HTR2CHTR2BHTR1DHTR1BALDH1A1
SCHEMBL14507277 0.76
SCHEMBL4248733 0.75 HTR2C (0.37) HTR2CHTR2AHTR2BALDH1A1MAPT
SCHEMBL4478534 0.75 HTR2C (0.37) HTR2CHTR2AHTR2BALDH1A1MAPT
SCHEMBL13627323 0.75 HTR2C (0.37) HTR2CHTR2AHTR2BALDH1A1MAPT
SCHEMBL21865764 0.70 PTGS1 (0.33) HTR2CHTR2AHTR2B
SCHEMBL31607527 0.69 MEN1 (0.58) HTR2CHTR2AHTR2BCA1CA2
SCHEMBL5676541 0.68 TRPM2 (0.31)

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-20060100230-A1 Indolin phenylsulfonamide derivatives BAYER HEALTHCARE AG (DE) 2006-05-11 US disclosed
CN-1678581-A Indolin phenylsulfonamide derivatives BAYER HEALTHCARE AG (DE) 2005-10-05 CN disclosed
EP-1519919-A1 INDOLIN PHENYLSULFONAMIDE DERIVATIVES Bayer HealthCare AG (DE) 2005-04-06 EP disclosed
WO-2004005253-A1 INDOLIN PHENYLSULFONAMIDE DERIVATIVES BAYER HEALTHCARE AG (DE) 2004-01-15 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-20060100230-A1 Indolin phenylsulfonamide derivatives PPARD, PPARA, PPARG HTR2C 456/4885HTR2A 263/4885HTR2B 210/4885

“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.