SCHEMBL6733829

SCHEMBL6733829

COCc1c(S(=O)(=O)N2CCN(C(=O)c3ccc(-c4cc[n+]([O-])cc4)cc3)CC2)[nH]c2ccc(Cl)cc12

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F10 P00742 13/20 0.49
KLK1 P06870 1/20 0.47
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
MAP2 P11137 1/20 0.41
JAK2 O60674 1/20 0.39
JAK1 P23458 1/20 0.39
TYK2 P29597 1/20 0.39
JAK3 P52333 1/20 0.39
BTK Q06187 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
USP2 O75604 1/20 0.38
HPGD P15428 1/20 0.38
TLR8 Q9NR97 1/20 0.38
TLR7 Q9NYK1 1/20 0.38

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
SCHEMBL6726146 0.92 F10 (0.46) F10KLK1MEN1KMT2AMAP2
SCHEMBL6729341 0.90 F10 (0.46) F10KLK1MEN1KMT2AMAP2
SCHEMBL6726599 0.89 F10 (0.40) F10KLK1MEN1KMT2ACYP3A4
SCHEMBL6726115 0.89 F10 (0.50) F10KLK1MEN1KMT2AMAP2
SCHEMBL6729442 0.88 F10 (0.47) F10KLK1MEN1KMT2AMAP2
SCHEMBL6786248 0.86 F10 (0.44) F10KLK1MAP2
SCHEMBL6733956 0.86 F10 (0.47) F10KLK1MEN1KMT2AMAP2
SCHEMBL6735051 0.85 F10 (0.46) F10KLK1MEN1KMT2AMAP2
SCHEMBL6729605 0.83 F10 (0.44) F10KLK1MEN1KMT2AMAP2
SCHEMBL6730196 0.81 F10 (0.38) F10KLK1MEN1KMT2ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6747023-B1 INHIBITORS FOR ACTIVATED COAGULATION FACTOR X, COAGULATION SUPPRESSORS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-06-08 US disclosed
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 F10 19/4885KLK1 3139/4885MEN1 2216/4885

“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.