SCHEMBL2210962

SCHEMBL2210962

O=C(CSc1nc(-c2cccc(NS(=O)(=O)c3ccccc3)c2)cs1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 8/20 0.59
CCR1 P32246 5/20 0.59
SIGMAR1 Q99720 4/20 0.50
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
HTT P42858 2/20 0.44
LMNA P02545 2/20 0.44
AURKA O14965 1/20 0.42
KDR P35968 1/20 0.42
FLT3 P36888 1/20 0.42

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
SCHEMBL2208333 0.93 CCR3 (0.56) CCR3CCR1SIGMAR1MEN1KMT2A
Hydrochloric Acid SCHEMBL2210249 0.90 CCR3 (0.59) CCR3CCR1SIGMAR1MEN1KMT2A
SCHEMBL12511831 0.88 CCR3 (0.60) CCR3CCR1SIGMAR1MEN1KMT2A
SCHEMBL2214541 0.88 CCR3 (0.53) CCR3CCR1SIGMAR1MEN1KMT2A
SCHEMBL2212722 0.88 CCR3 (0.59) CCR3CCR1SIGMAR1MEN1KMT2A
SCHEMBL2210893 0.88 CCR3 (0.59) CCR3CCR1SIGMAR1MEN1KMT2A
Hydrochloric Acid SCHEMBL2214309 0.88 CCR3 (0.59) CCR3CCR1SIGMAR1MEN1KMT2A
SCHEMBL2214864 0.87 CCR3 (0.55) CCR3CCR1SIGMAR1MEN1KMT2A
SCHEMBL2242547 0.86 CCR3 (0.59) CCR3CCR1SIGMAR1MEN1KMT2A
SCHEMBL2211713 0.86 CCR3 (0.59) CCR3CCR1SIGMAR1MEN1KMT2A

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
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 CCR3 21/4885CCR1 11/4885SIGMAR1 2000/4885

“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.