SCHEMBL2211234

SCHEMBL2211234

CC(=O)c1ccc(S(=O)(=O)CCCC(=O)NC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.56
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
MCHR1 Q99705 2/20 0.52
UTS2R Q9UKP6 2/20 0.47
CCR3 P51677 5/20 0.46
CCR1 P32246 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
SSTR5 P35346 1/20 0.44
KCNH2 Q12809 1/20 0.44
BDKRB1 P46663 1/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43

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
SCHEMBL12511780 0.89 SIGMAR1 (0.61) SIGMAR1MEN1KMT2AMCHR1UTS2R
SCHEMBL2215875 0.88 SIGMAR1 (0.60) SIGMAR1MEN1KMT2AMCHR1UTS2R
SCHEMBL2213070 0.84 UTS2R (0.64) SIGMAR1MEN1KMT2AMCHR1UTS2R
SCHEMBL2211738 0.83 SIGMAR1 (0.55) SIGMAR1MEN1KMT2AMCHR1UTS2R
SCHEMBL2212156 0.83 SIGMAR1 (0.56) SIGMAR1MEN1KMT2AMCHR1UTS2R
SCHEMBL2214839 0.83 UTS2R (0.65) SIGMAR1MEN1KMT2AMCHR1UTS2R
SCHEMBL2212892 0.81 SIGMAR1 (0.73) SIGMAR1MEN1KMT2AMCHR1
SCHEMBL2211108 0.81 UTS2R (0.62) SIGMAR1MEN1KMT2AMCHR1UTS2R
SCHEMBL2212835 0.79 MCHR1 (0.55) SIGMAR1MEN1KMT2AMCHR1UTS2R
SCHEMBL2210339 0.79 ADIPOR2 (0.63) SIGMAR1MEN1KMT2AMCHR1UTS2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1389616-B1 3,4-Dihalobenzylpiperidine derivatives and their medical use MITSUBISHI TANABE PHARMA CORP (JP) 2011-07-27 EP disclosed
EP-1389616-B1 3,4-Dihalobenzylpiperidine derivatives and their medical use MITSUBISHI TANABE PHARMA CORP (JP) 2011-07-27 EP disclosed
US-7115635-B2 Benzylpiperidine compound MITSUBISHI PHARMA CORPORATION (JP) 2006-10-03 US disclosed
US-20040158071-A1 Chemokine inhibitors and stability in blood MITSUBISHI PHARMA CORPORATION (JP) 2004-08-12 US disclosed
EP-1389616-A1 NOVEL BENZYLPIPERIDINE COMPOUND Mitsubishi Pharma Corporation (JP) 2004-02-18 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-20040158071-A1 Chemokine inhibitors and stability in blood CCL2, CXCR1, CCR5 SIGMAR1 2000/4885MEN1 3525/4885KMT2A 3818/4885

“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.