SCHEMBL6730348

SCHEMBL6730348

CC(O)C1CN(S(=O)(=O)/C=C/c2ccc(Cl)cc2O)CC(C(C)O)N1c1ncc(-c2ccncc2)cn1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 5/20 0.35
CYP21A2 P08686 4/20 0.35
CYP11B1 P15538 3/20 0.35
ALDH1A1 P00352 2/20 0.31
PDGFRB P09619 1/20 0.31
PDGFRA P16234 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL6730354 1.00 CYP17A1 (0.35) CYP17A1CYP21A2CYP11B1ALDH1A1PDGFRB
SCHEMBL6730350 0.85 PDGFRB (0.31) ALDH1A1PDGFRBPDGFRAKDM4EMEN1
SCHEMBL6729436 0.83 F10 (0.33) ALDH1A1KDM4EMEN1KMT2ANPSR1
SCHEMBL6726791 0.83 F10 (0.32) ALDH1A1KDM4EMEN1KMT2ANPSR1
SCHEMBL6726790 0.83 F10 (0.32) ALDH1A1KDM4EMEN1KMT2ANPSR1
SCHEMBL6729435 0.83 F10 (0.33) ALDH1A1KDM4EMEN1KMT2ANPSR1
SCHEMBL6726639 0.80 CYP17A1 (0.39) CYP17A1CYP21A2CYP11B1ALDH1A1PDGFRB
SCHEMBL6726636 0.80 CYP17A1 (0.39) CYP17A1CYP21A2CYP11B1ALDH1A1PDGFRB
SCHEMBL6728993 0.79 ENPP2 (0.36) ALDH1A1KDM4EMEN1KMT2ANPSR1
SCHEMBL6781804 0.79 ENPP2 (0.36) ALDH1A1KDM4EMEN1KMT2ANPSR1

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 CYP17A1 946/4885CYP21A2 584/4885CYP11B1 169/4885

“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.