SCHEMBL4814829

SCHEMBL4814829

O=S(=O)(/C=C/c1ccccc1)N1CCN(c2ccc(F)cc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 1.00
KMT2A Q03164 3/20 1.00
MEN1 O00255 2/20 1.00
TSHR P16473 1/20 0.81
GAA P10253 3/20 0.70
MAPT P10636 2/20 0.70
GPR183 P32249 2/20 0.65
SMN1; SMN2 Q16637 2/20 0.64
NPSR1 Q6W5P4 1/20 0.60
ALDH1A1 P00352 5/20 0.56
HPGD P15428 1/20 0.56
POLB P06746 2/20 0.53
YAP1 P46937 1/20 0.52
TEAD4 Q15561 1/20 0.52
KDM4E B2RXH2 1/20 0.51
GBA1 P04062 1/20 0.51

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
SCHEMBL4814836 1.00 LMNA (1.00) LMNAKMT2AMEN1TSHRGAA
SCHEMBL4818267 0.90 TSHR (1.00) LMNAKMT2AMEN1TSHRGAA
SCHEMBL4818264 0.90 TSHR (1.00) LMNAKMT2AMEN1TSHRGAA
SCHEMBL3934524 0.80 GAA (0.68) LMNAKMT2AMEN1TSHRGAA
SCHEMBL3934517 0.80 GAA (0.68) LMNAKMT2AMEN1TSHRGAA
SCHEMBL27475553 0.79 GPR183 (0.66) LMNAKMT2AMEN1TSHRGAA
SCHEMBL2156829 0.78 KMT2A (0.64) LMNAKMT2AMEN1TSHRGAA
SCHEMBL2155481 0.78 KMT2A (0.64) LMNAKMT2AMEN1TSHRGAA
SCHEMBL2155489 0.78 KMT2A (0.64) LMNAKMT2AMEN1TSHRGAA
SCHEMBL18864671 0.77 TSHR (0.71) LMNAKMT2AMEN1TSHRGAA

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 LMNA 3582/4885KMT2A 2279/4885MEN1 4343/4885

“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.