SCHEMBL6724741

SCHEMBL6724741

COc1ccc(OC)c(S(=O)(=O)Nc2cccc(C3=NCCc4cc(Cl)ccc43)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.53
MAPK10 P53779 3/20 0.52
MAPK9 P45984 1/20 0.52
MAPK14 Q16539 1/20 0.52
MAPT P10636 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
ALPL P05186 6/20 0.50
NPSR1 Q6W5P4 1/20 0.48
USP2 O75604 1/20 0.48
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47

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
SCHEMBL6718356 0.93 TP53 (0.53) TP53MAPK10MAPK9MAPK14MAPT
SCHEMBL6725304 0.90 SMN1; SMN2 (0.61) TP53MAPK10MAPTSMN1; SMN2ALPL
SCHEMBL6716920 0.84 SMN1; SMN2 (0.61) TP53MAPK10MAPTSMN1; SMN2ALPL
SCHEMBL6724989 0.84 TP53 (0.54) TP53SMN1; SMN2ALPLNPSR1CA1
SCHEMBL6724930 0.82 GSPT1 (0.45) TP53MAPK10MAPK9MAPK14
SCHEMBL6718273 0.80 LMNA (0.57) TP53SMN1; SMN2ALPLNPSR1CA1
SCHEMBL7210287 0.79 CA1 (0.54) MAPK10SMN1; SMN2ALPLNPSR1CA1
SCHEMBL6724669 0.79 PFKFB3 (0.53) TP53MAPK10MAPK9MAPK14MAPT
SCHEMBL6720429 0.79 LMNA (0.50) TP53MAPK10MAPK9MAPK14MAPT
SCHEMBL6724570 0.79 LMNA (0.46) TP53MAPK10MAPK9MAPK14MAPT

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-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
EP-1337515-A1 (DIHYDRO)ISOQUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2003-08-27 EP disclosed
WO-2002040450-A1 (DIHYDRO)ISOQUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS ALTANA PHARMA AG (DE) 2002-05-23 WO 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 TP53 4504/4885MAPK10 1836/4885MAPK9 2308/4885

“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.