SCHEMBL7150571

SCHEMBL7150571

O=C(NO)C(CS(=O)(=O)N1CCN(c2ccc(Cl)cn2)CC1)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PANK3 Q9H999 1/20 0.43
CTSS P25774 3/20 0.43
DRD2 P14416 4/20 0.41
DRD4 P21917 3/20 0.41
MMP7 P09237 1/20 0.41
HDAC8 Q9BY41 1/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
NAMPT P43490 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CHRM1 P11229 1/20 0.39
GPR119 Q8TDV5 1/20 0.38

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
SCHEMBL7155176 0.91 PANK3 (0.44) PANK3DRD2DRD4MMP7ALDH1A1
SCHEMBL14252793 0.77 DRD2 (0.49) PANK3CTSSDRD2DRD4MMP7
SCHEMBL4813294 0.77 DRD2 (0.42) PANK3CTSSDRD2DRD4MMP7
SCHEMBL16495543 0.76 PANK3 (0.40) PANK3DRD2DRD4MMP7ALDH1A1
SCHEMBL4610993 0.76 LMNA (0.49) ALDH1A1MAPTMEN1KMT2A
SCHEMBL4673423 0.75 RORC (0.42) PANK3DRD2DRD4MMP7HDAC8
SCHEMBL4673431 0.75 RORC (0.42) PANK3DRD2DRD4MMP7HDAC8
SCHEMBL6787976 0.74 RET (0.40) PANK3HDAC8KMT2AGPR119
SCHEMBL6787183 0.74 RET (0.40) PANK3HDAC8KMT2AGPR119
SCHEMBL4671294 0.74 MMP1 (0.41) PANK3DRD2DRD4ALDH1A1KDM4E

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
US-20030139419-A1 Arylpiperazines and arylpiperidines and their use as metalloproteinase inhibiting agents ASTRAZENECA AB (SE) 2003-07-24 US claimed
US-20030139419-A1 Arylpiperazines and arylpiperidines and their use as metalloproteinase inhibiting agents ASTRAZENECA AB (SE) 2003-07-24 US disclosed
EP-1261595-A1 ARYLPIPERAZINES AND ARYLPIPERIDINES AND THEIR USE AS METALLOPROTEINASE INHIBITING AGENTS AstraZeneca AB (SE) 2002-12-04 EP disclosed
WO-2001062751-A1 ARYLPIPERAZINES AND ARYLPIPERIDINES AND THEIR USE AS METALLOPROTEINASE INHIBITING AGENTS ASTRAZENECA AB (SE) 2001-08-30 WO 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-20030139419-A1 Arylpiperazines and arylpiperidines and their use as metalloproteinase inhibiting agents MMP13, MMP3, MMP2 PANK3 4042/4885CTSS 163/4885DRD2 2378/4885

“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.