SCHEMBL5128701

SCHEMBL5128701

O=C(COCC1Cc2ccccc2CN1S(=O)(=O)c1ccc(Cl)cc1Cl)N1CCC(O)(c2ccc(Cl)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 13/20 0.41
MAPT P10636 1/20 0.40
EPHX2 P34913 1/20 0.39
GRM5 P41594 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
DRD3 P35462 1/20 0.36
POLB P06746 1/20 0.36
CHRM4 P08173 1/20 0.36

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
SCHEMBL5131980 0.97 EPHX2 (0.43) CCR1MAPTEPHX2GRM5POLB
SCHEMBL5126144 0.90 ALDH1A1 (0.44) CCR1GRM5MEN1KMT2APOLB
SCHEMBL5126152 0.90 ALDH1A1 (0.44) CCR1GRM5MEN1KMT2APOLB
Hydrochloric Acid SCHEMBL5129387 0.90 ALDH1A1 (0.44) CCR1GRM5MEN1KMT2APOLB
SCHEMBL5128421 0.88 EPHX2 (0.44) EPHX2GRM5POLB
SCHEMBL3837762 0.86 MEN1 (0.44) CCR1MAPTEPHX2GRM5MEN1
SCHEMBL2571091 0.83 PSEN1 (0.43) GRM5
SCHEMBL5128012 0.83 BDKRB1 (0.43) CCR1MAPTEPHX2POLB
SCHEMBL2570113 0.82 PSEN1 (0.44)
SCHEMBL3813955 0.82 POLB (0.43) MAPTMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 US claimed
US-8580965-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-11-12 US disclosed
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 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 (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-20080249128-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, NPSR1 CCR1 598/4885MAPT 2073/4885EPHX2 1287/4885

“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.