SCHEMBL4892974

SCHEMBL4892974

NC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1

nearest known ligand 0.80

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.62
TSHR P16473 1/20 0.56
YAP1 P46937 1/20 0.55
TEAD4 Q15561 1/20 0.55
GAA P10253 1/20 0.53
ALDH1A1 P00352 6/20 0.52
KMT2A Q03164 5/20 0.52
GPR183 P32249 1/20 0.52
LMNA P02545 3/20 0.51
MEN1 O00255 4/20 0.51
KDM4E B2RXH2 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HTT P42858 1/20 0.50
RECQL P46063 1/20 0.49

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
SCHEMBL7356750 0.89 USP2 (0.78) USP2TSHRYAP1TEAD4GAA
SCHEMBL4815957 0.89 USP2 (0.78) USP2TSHRYAP1TEAD4GAA
SCHEMBL5949547 0.82 TSHR (0.61) USP2TSHRYAP1TEAD4GAA
SCHEMBL5949555 0.82 TSHR (0.61) USP2TSHRYAP1TEAD4GAA
SCHEMBL21800682 0.80 GAA (0.69) USP2YAP1TEAD4GAAALDH1A1
SCHEMBL21800599 0.79 TSHR (0.57) USP2TSHRYAP1TEAD4GAA
SCHEMBL10273453 0.79 ALDH1A1 (0.52) USP2TSHRYAP1TEAD4GAA
SCHEMBL21800713 0.78 EPHX2 (0.55) USP2TSHRYAP1TEAD4KMT2A
SCHEMBL5368158 0.77 RAB9A (0.69) GAAALDH1A1KMT2ALMNAMEN1
SCHEMBL27525127 0.77 RAB9A (0.69) GAAALDH1A1KMT2ALMNAMEN1

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 6 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
EP-1109787-A1 ARYLPIPERAZINES AND THEIR USE AS METALLOPROTEINASE INHIBITING AGENTS (MMP) AstraZeneca AB (SE) 2001-06-27 EP disclosed
WO-2000012478-A1 ARYLPIPERAZINES AND THEIR USE AS METALLOPROTEINASE INHIBITING AGENTS (MMP) ASTRAZENECA AB (SE) 2000-03-09 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-20040171641-A1 Arylpiperazines and their use as metalloproteinase inhibiting agents (MMP) MMP13, MMP25, MMP3 USP2 1877/4885TSHR 2604/4885YAP1 3549/4885

“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.