SCHEMBL6714964

SCHEMBL6714964

O=S(=O)(Nc1ccc(C2=NCCc3cc(F)ccc32)cc1)c1ccc(F)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SGK1 O00141 7/20 0.49
MAPK10 P53779 2/20 0.47
BRD4 O60885 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA7 P43166 2/20 0.45
CA9 Q16790 2/20 0.45
CA14 Q9ULX7 2/20 0.45
PFKFB3 Q16875 1/20 0.44
ITGA1 P56199 1/20 0.41
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
FABP4 P15090 1/20 0.40
FABP5 Q01469 1/20 0.40
HTR6 P50406 1/20 0.40
POLB P06746 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
SCHEMBL6717898 0.93 SGK1 (0.46) SGK1MAPK10BRD4CA1CA2
SCHEMBL6724974 0.92 ITGA1 (0.47) SGK1MAPK10BRD4CA1CA2
SCHEMBL6718834 0.91 SGK1 (0.47) SGK1MAPK10BRD4CA1CA2
SCHEMBL6718381 0.91 SGK1 (0.45) SGK1MAPK10BRD4CA1CA2
SCHEMBL6716678 0.91 ITGA1 (0.46) SGK1MAPK10BRD4PFKFB3ITGA1
SCHEMBL7210296 0.89 PFKFB3 (0.56) SGK1MAPK10BRD4PFKFB3ITGA1
SCHEMBL6714977 0.86 GSPT1 (0.45) SGK1MAPK10CA1CA2CA7
SCHEMBL6715037 0.84 SGK1 (0.45) SGK1MAPK10BRD4PFKFB3LMNA
SCHEMBL7209077 0.84 MAPK10 (0.43) SGK1MAPK10CA1CA2CA7
SCHEMBL6724899 0.84 SGK1 (0.48) SGK1MAPK10CA1CA2CA7

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-6818651-B2 ANTIINFLAMMATORY, ANTIASTHMATIC, SKIN, AND AUTOIMMUNE DISORDERS; CROHN*S DISEASE, ULCERATIVE COLITIS, CONJUCTIVITIS, MULTIPLE SCLEROSIS, AND RHEUMATOID ARTHRITIS; CHRONIC OBSTRUCTIVE PULMONARY DISEASE ALTANA PHARMA AG (DE) 2004-11-16 US disclosed
US-20040044212-A1 (Dihydro) Isoquinoline derivatives as phosphodiesterase inhibitors ALTANA PHARMA AG (DE) 2004-03-04 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-20040044212-A1 (Dihydro) Isoquinoline derivatives as phosphodiesterase inhibitors PDE7B, PDE3B, PDE3A SGK1 4293/4885MAPK10 1836/4885BRD4 1595/4885

“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.