SCHEMBL4479565

SCHEMBL4479565

O=C(O)N1CCN(CCC(=O)N2CCC2)CC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 11/20 0.54
▸ HTR1A P08908 7/20 0.54
▸ ATM Q13315 1/20 0.47
▸ TSHR P16473 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ SIGMAR1 Q99720 1/20 0.42

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
SCHEMBL4462112 0.92 KMT2A (0.48) HTR7HTR1ALMNAKMT2ATDP1
SCHEMBL4813984 0.85 HTR7 (0.61) HTR7HTR1AATMTSHRALDH1A1
SCHEMBL3439885 0.81 ATM (0.62) HTR7HTR1AATMALDH1A1SMN1; SMN2
SCHEMBL4322770 0.81 CYP1A2 (0.43) HTR7HTR1AALDH1A1SMN1; SMN2MEN1
SCHEMBL949323 0.79 ALDH1A1 (0.61) HTR7HTR1AATMALDH1A1SMN1; SMN2
SCHEMBL19717363 0.78 HSD11B1 (0.45) TSHRALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL4326132 0.77 CYP1A2 (0.48) ALDH1A1SMN1; SMN2KMT2A
SCHEMBL4000787 0.77 ITGB3 (0.52) HTR7HTR1AATMALDH1A1SMN1; SMN2
SCHEMBL20338317 0.76 GAA (0.69) ATMTSHRALDH1A1SMN1; SMN2KDM4E
SCHEMBL27610484 0.76 PAOX (0.48) HTR7HTR1AALDH1A1SMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7538111-B2 Benzenesulphonamide derivatives, method for production and use thereof for treatment of pain LABORATOIRES FOURNIER S.A. (FR) 2009-05-26 — — US disclosed
US-20060178360-A1 Benzenesulphonamide derivatives, method for production and use thereof for treatment of pain LABORATOIRES FOURNIER S.A. (FR) 2006-08-10 — — 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-20060178360-A1 Benzenesulphonamide derivatives, method for production and use thereof for treatment of pain LTB4R2, BDKRB2, TBXA2R HTR7 615/4885HTR1A 791/4885ATM 2832/4885

“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.

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