SCHEMBL6893849

SCHEMBL6893849

CC(C)(C)OC(=O)N1CCC(CN2CCN(S(=O)(=O)c3ccc(-c4ccc(Cl)cc4)s3)CC2=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 9/20 0.46
MMP1 P03956 2/20 0.46
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
STS P08842 4/20 0.42
P2RY14 Q15391 1/20 0.40
NR1D1 P20393 1/20 0.40
GPR119 Q8TDV5 2/20 0.39
FPR2 P25090 1/20 0.39

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
SCHEMBL6888393 0.85 POLB (0.52) KDM4EMAPTGPR119FPR2
SCHEMBL6896849 0.83 KDM4E (0.41) KDM4EMAPTGPR119FPR2
SCHEMBL4388695 0.83 F10 (0.54)
SCHEMBL27548660 0.83 MMP13 (0.45) MMP13MMP1KDM4EMAPTSTS
Hydrochloric Acid SCHEMBL6896345 0.81 F10 (0.42)
SCHEMBL6895114 0.79 STS (0.46) KDM4EMAPTSTSGPR119
SCHEMBL6886477 0.78 F10 (0.45) MAPT
SCHEMBL6896691 0.77 FPR2 (0.42) KDM4ESTSGPR119FPR2
SCHEMBL6892089 0.76 MMP13 (0.43) MMP13KDM4EMAPTSTSGPR119
SCHEMBL7046610 0.76 GPR119 (0.42) MAPTSTSGPR119FPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6680312-B2 FOR THERAPY OF CARDIAC INFARCTION, CEREBRAL THROMBOSIS; INHIBIT ACTIVATED COAGULATION FACTOR X (FXA) TO SHOW ANTI-COAGULANT ACTIVITY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2004-01-20 US disclosed
US-20020193382-A1 Sulfonamide derivatives, their production and use TAKEDA PHARMACEUTICAL COMPANY, LIMITED (JP) 2002-12-19 US disclosed
US-6403595-B1 ANTICOAGULANTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-06-11 US disclosed
EP-1054005-A1 SULFONAMIDE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND UTILIZATION THEREOF Takeda Chemical Industries, Ltd. (JP) 2000-11-22 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-20020193382-A1 Sulfonamide derivatives, their production and use F12, F11, F2 MMP13 805/4885MMP1 596/4885KDM4E 1392/4885

“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.