SCHEMBL2214028

SCHEMBL2214028

Nc1cccc(-c2noc(CCC(=O)NC3CCN(Cc4ccc(Cl)c(Cl)c4)CC3)n2)c1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.62
TSHR P16473 3/20 0.62
HTT P42858 1/20 0.62
ATM Q13315 1/20 0.62
TDP1 Q9NUW8 1/20 0.59
CCR1 P32246 2/20 0.53
CCR3 P51677 2/20 0.53
SIGMAR1 Q99720 2/20 0.52
HPGD P15428 2/20 0.51
ALDH1A1 P00352 1/20 0.51
LMNA P02545 3/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
USP2 O75604 1/20 0.50

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
SCHEMBL2213531 0.88 SMN1; SMN2 (0.58) SMN1; SMN2TSHRHTTATMTDP1
SCHEMBL4033845 0.87 SMN1; SMN2 (0.65) SMN1; SMN2TSHRHTTATMTDP1
SCHEMBL2212747 0.86 TSHR (0.60) SMN1; SMN2TSHRHTTATMTDP1
SCHEMBL4032891 0.83 SMN1; SMN2 (0.60) SMN1; SMN2TSHRHTTATMTDP1
SCHEMBL4033978 0.82 HTT (0.59) SMN1; SMN2TSHRHTTATMTDP1
SCHEMBL4032532 0.81 ATM (0.55) SMN1; SMN2TSHRHTTATMTDP1
SCHEMBL2215908 0.81 TSHR (0.57) SMN1; SMN2TSHRHTTATMTDP1
SCHEMBL4031558 0.80 TSHR (0.56) SMN1; SMN2TSHRHTTATMTDP1
SCHEMBL2213127 0.77 CCR3 (0.66) CCR1CCR3SIGMAR1ALDH1A1KMT2A
SCHEMBL4031280 0.77 TSHR (0.58) SMN1; SMN2TSHRHTTATMTDP1

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 SMN1; SMN2 3712/4885TSHR 3929/4885HTT 4507/4885

“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.