SCHEMBL6736082

SCHEMBL6736082

O=S(=O)(CCC1CN(S(=O)(=O)c2cc3cc(Cl)ccc3n2S(=O)(=O)c2ccccc2)CCN1)N1CCCC1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.41
PPARA Q07869 4/20 0.41
PPARD Q03181 4/20 0.41
OPRK1 P41145 1/20 0.38
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.34
CNR2 P34972 1/20 0.34
HTR6 P50406 4/20 0.33
ACLY P53396 1/20 0.33
CHRM1 P11229 1/20 0.33
DRD2 P14416 1/20 0.33
DPP4 P27487 1/20 0.33

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
SCHEMBL6730522 0.93 PPARG (0.39) PPARGPPARAPPARDOPRK1ALDH1A1
SCHEMBL6791341 0.89 PPARG (0.41) PPARGPPARAPPARDOPRK1ALDH1A1
SCHEMBL6733146 0.86 PPARG (0.45) PPARGPPARAPPARDOPRK1ALDH1A1
SCHEMBL6731589 0.85 PPARG (0.41) PPARGPPARAPPARDOPRK1ALDH1A1
SCHEMBL6728741 0.85 PPARG (0.41) PPARGPPARAPPARDALDH1A1KDM4E
SCHEMBL6725421 0.83 PPARG (0.43) PPARGPPARAPPARDOPRK1ALDH1A1
SCHEMBL6737263 0.82 PPARG (0.39) PPARGPPARAPPARDALDH1A1KDM4E
SCHEMBL6725126 0.81 PPARG (0.41) PPARGPPARAPPARDOPRK1ALDH1A1
SCHEMBL6733597 0.81 PPARG (0.38) PPARGPPARAPPARDOPRK1ALDH1A1
SCHEMBL6732137 0.81 PPARG (0.44) PPARGPPARAPPARDALDH1A1KMT2A

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-6747023-B1 INHIBITORS FOR ACTIVATED COAGULATION FACTOR X, COAGULATION SUPPRESSORS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-06-08 US disclosed
US-20040082611-A1 Anticoagulants; brain disorders; respiratory system disorders; side effect reduction DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-29 US disclosed
EP-1104754-A1 NOVEL SULFONYL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-06-06 EP 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-20040082611-A1 Anticoagulants; brain disorders; respiratory system disorders; side effect reduction F2, CYC1, SULT2A1 PPARG 1204/4885PPARA 573/4885PPARD 875/4885

“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.