SCHEMBL1497170

SCHEMBL1497170

O=C1CCC(=Cc2ccccc2-c2ccc(Cl)cc2)CC1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 1/20 0.39
MAOB P27338 4/20 0.39
PTGS2 P35354 2/20 0.38
PTGS1 P23219 1/20 0.38
FLT3 P36888 2/20 0.36
ACHE P22303 1/20 0.36
BACE1 P56817 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
CYP1A2 P05177 1/20 0.34
RAB9A P51151 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL8314577 0.81 SIGMAR1 (0.40) PTGS2PTGS1CYP1A2
SCHEMBL13503986 0.76 DYRK2 (0.51) ACHE
SCHEMBL11314812 0.74 CYP2C19 (0.43) MAOBSLC6A4SLC6A3RAB9A
Hydrochloric Acid SCHEMBL11035724 0.73 CYP2C19 (0.42) MAOBSLC6A4SLC6A3RAB9A
SCHEMBL8316880 0.73 HRH3 (0.39) MEN1KMT2A
SCHEMBL387189 0.72 XDH (0.51) PTGS2PTGS1SLC6A4SLC6A3CYP1A2
SCHEMBL1742829 0.72 ENPP2 (0.45) RAB9AMEN1KMT2A
SCHEMBL7929268 0.69 PTGER1 (0.44) PTGS2PTGS1BACE1SLC6A4SLC6A3
SCHEMBL13504087 0.69 IKBKB (0.51) ACHERAB9AKMT2A
SCHEMBL13504083 0.69 TTR (0.47) CYP26A1ACHECYP1A2RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8809352-B2 Sulfonamides as inhibitors of Bcl-2 family proteins for the treatments of cancer NOVARTIS AG (CH) 2014-08-19 US disclosed
US-8809352-B2 Sulfonamides as inhibitors of Bcl-2 family proteins for the treatments of cancer NOVARTIS AG (CH) 2014-08-19 US disclosed
US-8809352-B2 Sulfonamides as inhibitors of Bcl-2 family proteins for the treatments of cancer NOVARTIS AG (CH) 2014-08-19 US disclosed
EP-2475661-B1 SULFONAMIDES AS INHIBITORS OF BCL-2 FAMILY PROTEINS FOR THE TREATMENT OF CANCER NOVARTIS AG (CH) 2013-10-23 EP disclosed
EP-2475661-A1 SULFONAMIDES AS INHIBITORS OF BCL-2 FAMILY PROTEINS FOR THE TREATMENT OF CANCER Novartis AG (CH) 2012-07-18 EP disclosed
US-20120165298-A1 SULFONAMIDE COMPOUNDS NOVARTIS AG (CH) 2012-06-28 US disclosed
US-20120165298-A1 SULFONAMIDE COMPOUNDS NOVARTIS AG (CH) 2012-06-28 US disclosed
US-20120165298-A1 SULFONAMIDE COMPOUNDS NOVARTIS AG (CH) 2012-06-28 US disclosed
WO-2011029842-A1 SULFONAMIDES AS INHIBITORS OF BCL-2 FAMILY PROTEINS FOR THE TREATMENT OF CANCER NOVARTIS AG (CH) 2011-03-17 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-20120165298-A1 SULFONAMIDE COMPOUNDS BCLAF1, BCL2L11, BCL2 CYP26A1 3863/4885MAOB 4727/4885PTGS2 459/4885

“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.