SCHEMBL6730822

SCHEMBL6730822

O=C(c1ccc(-c2ccncc2)cc1)N1CCN(S(=O)(=O)c2[nH]c3ccc(Cl)cc3c2CO)CC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LSS P48449 2/20 0.48
F10 P00742 9/20 0.47
KLK1 P06870 1/20 0.47
MAP2 P11137 1/20 0.44
ALDH1A1 P00352 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
ATM Q13315 1/20 0.41
LMNA P02545 1/20 0.41
THRB P10828 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
AKR1C3 P42330 1/20 0.40

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
SCHEMBL6786248 0.94 F10 (0.44) LSSF10KLK1MAP2ALDH1A1
SCHEMBL6726115 0.90 F10 (0.50) LSSF10KLK1MAP2ALDH1A1
SCHEMBL6730891 0.88 F10 (0.51) LSSF10KLK1MAP2ALDH1A1
SCHEMBL6729341 0.88 F10 (0.46) F10KLK1MAP2ALDH1A1L3MBTL1
SCHEMBL6729450 0.85 F10 (0.50) LSSF10KLK1MAP2ALDH1A1
SCHEMBL6729605 0.83 F10 (0.44) F10KLK1MAP2LMNAMEN1
SCHEMBL6730899 0.83 F10 (0.49) LSSF10KLK1MAP2ALDH1A1
SCHEMBL6732153 0.83 ALDH1A1 (0.37) LSSF10ALDH1A1L3MBTL1LMNA
SCHEMBL5196283 0.79 F10 (0.71) LSSF10KLK1
SCHEMBL6781215 0.78 F10 (0.37) F10KLK1ALDH1A1L3MBTL1LMNA

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-20040082611-A1 Anticoagulants; brain disorders; respiratory system disorders; side effect reduction DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-29 US disclosed
EP-1104754-A1 NOVEL SULFONYL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2001-06-06 EP 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-20040082611-A1 Anticoagulants; brain disorders; respiratory system disorders; side effect reduction F2, CYC1, SULT2A1 LSS 1745/4885F10 19/4885KLK1 3139/4885

“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.