SCHEMBL4812342

SCHEMBL4812342

O=S(=O)(CC(CCc1ccccc1)NO)N1CCN(c2cc(Cl)ncn2)CC1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.39
TSHR P16473 1/20 0.39
MCL1 Q07820 1/20 0.39
CTSS P25774 2/20 0.38
HRH4 Q9H3N8 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
PIK3CB P42338 1/20 0.34
SMO Q99835 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
HSD17B10 Q99714 1/20 0.34
OGA O60502 1/20 0.33
RORC P51449 1/20 0.33
PKM P14618 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
SCHEMBL4816824 0.86 GRM5 (0.41) KDM4ETSHRCTSSHRH4ALDH1A1
SCHEMBL4813294 0.83 DRD2 (0.42) KDM4ETSHRMCL1CTSSALDH1A1
SCHEMBL4816479 0.81 MMP7 (0.51) KDM4ETSHRMCL1CTSSHRH4
SCHEMBL4814260 0.74 OGA (0.38) KDM4ECTSSALDH1A1MAPTSMO
SCHEMBL14252773 0.73 MMP7 (0.51) KDM4ETSHRCTSSALDH1A1MAPT
SCHEMBL7358595 0.72 MMP7 (0.38) KDM4ETSHRCTSSHRH4ALDH1A1
SCHEMBL7362584 0.72 GRM5 (0.35) KDM4ECTSSHRH4ALDH1A1MAPT
SCHEMBL4809675 0.72 MMP7 (0.45) CTSSALDH1A1MAPT
SCHEMBL1266242 0.72 HDAC1 (0.43) KDM4ETSHRMCL1ALDH1A1MAPT
SCHEMBL14252771 0.70 MMP7 (0.53) KDM4ECTSSALDH1A1MAPTSMO

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-7342020-B2 Arylpiperazines and their use as metalloproteinase inhibiting agents (MMP) ASTRAZENECA AB (SE) 2008-03-11 US disclosed
EP-1109787-B1 ARYLPIPERAZINES AND THEIR USE AS METALLOPROTEINASE INHIBITING AGENTS (MMP) ASTRAZENECA AB (SE) 2006-05-17 EP disclosed
US-20040171641-A1 Arylpiperazines and their use as metalloproteinase inhibiting agents (MMP) ASTRAZENECA AB (SE) 2004-09-02 US disclosed
US-6734184-B1 Arylpiperazines and their use as metalloproteinase inhibiting agents (MMP) ASTRAZENECA AB (SE) 2004-05-11 US 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-20040171641-A1 Arylpiperazines and their use as metalloproteinase inhibiting agents (MMP) MMP13, MMP25, MMP3 KDM4E 2076/4885TSHR 2604/4885MCL1 837/4885

“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.