SCHEMBL4032869

SCHEMBL4032869

COc1ccc(S(=O)(=O)N2CCN(C(=O)c3ccccc3)C(C(=O)NCC(C)c3ccccc3)C2)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.46
ADAM17 P78536 1/20 0.46
LMNA P02545 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ATM Q13315 1/20 0.43
KMT2A Q03164 2/20 0.43
RXFP1 Q9HBX9 1/20 0.43
MEN1 O00255 1/20 0.43
TSHR P16473 2/20 0.42
MAPK1 P28482 2/20 0.42
ALDH1A1 P00352 1/20 0.42
GPBAR1 Q8TDU6 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TP53 P04637 1/20 0.41
USP2 O75604 1/20 0.41
GLA P06280 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL4035716 0.80 ALDH1A1 (0.46) POLBLMNAL3MBTL1GAASMN1; SMN2
SCHEMBL1382478 0.79 ALDH1A1 (0.53) POLBLMNAL3MBTL1MAPTGAA
SCHEMBL4034722 0.77 F10 (0.46) POLBADAM17LMNAATMTP53
SCHEMBL4032488 0.76 POLB (0.46) POLBSMN1; SMN2KMT2AMEN1TSHR
SCHEMBL4039378 0.71 MMP1 (0.52) POLBLMNAGAAALDH1A1USP2
SCHEMBL4036877 0.70 ALDH1A1 (0.52) POLBLMNAGAAALDH1A1TP53
SCHEMBL4038110 0.70 F2 (0.50) ADAM17LMNAMAPTGAASMN1; SMN2
SCHEMBL4033586 0.69 ALDH1A1 (0.55) POLBLMNAGAAALDH1A1USP2
SCHEMBL4035135 0.69 POLB (0.42) POLBLMNAMAPTGAASMN1; SMN2
SCHEMBL4034739 0.68 GAA (0.53) POLBLMNAMAPTGAASMN1; SMN2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1592389-B1 PIPERAZINE-2-CARBOXAMIDE DERIVATIVES SERONO LAB (CH) 2009-04-22 EP claimed
US-20070142391-A1 Piperazine-2-carboxamide derivatives MERCK SERONO SA (CH) 2007-06-21 US claimed
US-8404690-B2 Piperazine-2-carboxamide derivatives MERCK SERONO SA (CH) 2013-03-26 US disclosed
EP-1592389-B1 PIPERAZINE-2-CARBOXAMIDE DERIVATIVES SERONO LAB (CH) 2009-04-22 EP disclosed
US-20070142391-A1 Piperazine-2-carboxamide derivatives MERCK SERONO SA (CH) 2007-06-21 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-20070142391-A1 Piperazine-2-carboxamide derivatives P2RX5, P2RX2, NPY5R POLB 1416/4885ADAM17 3591/4885LMNA 976/4885

“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.