SCHEMBL630295

SCHEMBL630295

O=C1CN(c2cc3c(cc2OCc2ccccc2)CC(O)CC3)S(=O)(=O)N1Cc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 7/20 0.38
CHRNA7 P36544 2/20 0.37
PDE4B Q07343 1/20 0.36
SNRNP200 O75643 1/20 0.36
AGTR2 P50052 1/20 0.36
CYP19A1 P11511 1/20 0.35
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
REV1 Q9UBZ9 1/20 0.34
XIAP P98170 1/20 0.33
GRIN1 Q05586 1/20 0.33

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
SCHEMBL630191 0.91 CHRNA7 (0.36) HDAC6CHRNA7PDE4BSNRNP200AGTR2
SCHEMBL631410 0.85 CHRNA7 (0.40) HDAC6CHRNA7PDE4BSNRNP200CYP19A1
SCHEMBL630163 0.81 PTPN1 (0.43) HDAC6CHRNA7PDE4BSNRNP200AGTR2
SCHEMBL629810 0.76 CHRNA7 (0.39) HDAC6CHRNA7PDE4BSNRNP200CYP19A1
SCHEMBL629885 0.70 KDM4E (0.36) HDAC6PDE4B
SCHEMBL630286 0.69 KDM4E (0.38) CHRNA7REV1
SCHEMBL3579424 0.68 CYP19A1 (0.35) HDAC6CHRNA7PDE4BAGTR2CYP19A1
SCHEMBL3579427 0.67 CHRNA7 (0.33) CHRNA7PDE4BAGTR2
SCHEMBL630221 0.66 PTPN1 (0.49) CHRNA7SNRNP200CYP19A1CYP11B1CYP11B2
SCHEMBL3927311 0.66 CYP19A1 (0.36) CHRNA7CYP19A1CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1963292-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2012-02-22 EP disclosed
US-7700633-B2 Organic compounds NOVARTIS AG (CH) 2010-04-20 US disclosed
US-20080262050-A1 Organic Compounds NOVARTIS AG (CH) 2008-10-23 US disclosed
EP-1963292-A2 ORGANIC COMPOUNDS Novartis Pharma AG (CH) 2008-09-03 EP disclosed
WO-2007067615-A2 THIADIAZOLE DERIVATIVES AS ANTIDIABETIC AGENTS NOVARTIS AG (CH) 2007-06-14 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-20080262050-A1 Organic Compounds PTPRS, PTPRO, PTPRC HDAC6 3408/4885CHRNA7 4601/4885PDE4B 2509/4885

“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.