SCHEMBL1362866

SCHEMBL1362866

CC1CC(S(=O)(=O)c2ccc(Cl)cc2)c2c(F)ccc(F)c2O1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.37
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
PSEN1 P49768 11/20 0.34
APP P05067 10/20 0.34
PSEN2 P49810 10/20 0.34
APH1B Q8WW43 10/20 0.34
NCSTN Q92542 10/20 0.34
APH1A Q96BI3 10/20 0.34
PSENEN Q9NZ42 10/20 0.34
LMNA P02545 1/20 0.34
ACHE P22303 1/20 0.34
CYP2C9 P11712 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
SCHEMBL1362862 1.00 CYP3A4 (0.37) CYP3A4MEN1POLBKMT2APSEN1
SCHEMBL1362865 1.00 CYP3A4 (0.37) CYP3A4MEN1POLBKMT2APSEN1
SCHEMBL12147391 0.85 APP (0.37) CYP3A4PSEN1APPPSEN2APH1B
SCHEMBL8238192 0.85 APP (0.37) CYP3A4PSEN1APPPSEN2APH1B
SCHEMBL12147220 0.79 MEN1 (0.41) CYP3A4MEN1POLBKMT2APSEN1
SCHEMBL14461137 0.79 MEN1 (0.41) CYP3A4MEN1POLBKMT2APSEN1
SCHEMBL8237900 0.78 MMP2 (0.39) CYP3A4MEN1KMT2APSEN1PSEN2
SCHEMBL1362802 0.76 CYP3A4 (0.41) CYP3A4PSEN1APPPSEN2APH1B
SCHEMBL8231928 0.76 CYP3A4 (0.41) CYP3A4PSEN1APPPSEN2APH1B
SCHEMBL1366138 0.75 POLB (0.40) CYP3A4MEN1POLBKMT2APSEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8569521-B2 Benzenesulfonyl-chromane, thiochromane, tetrahydronaphthalene and related gamma secretase inhibitors MERCK SHARP & DOHME CORP. (US) 2013-10-29 US disclosed
EP-1976843-B1 CARBOCYCLIC AND HETEROCYCLIC ARYLSULFONES AS GAMMA SECRETASE INHIBITORS MERCK SHARP & DOHME (US) 2013-09-04 EP disclosed
US-20120264736-A1 BENZENESULFONYL-CHROMANE, THIOCHROMANE, TETRAHYDRONAPHTHALENE AND RELATED GAMMA SECRETASE INHIBITORS SCHERING CORPORATION (US) 2012-10-18 US disclosed
US-8067621-B2 Benzenesulfonyl-chromane, thiochromane, tetrahydronaphthalene and related gamma secretase inhibitors SCHERING CORPORATION (US) 2011-11-29 US disclosed
EP-1976843-A2 CARBOCYCLIC AND HETEROCYCLIC ARYLSULFONES AS GAMMA SECRETASE INHIBITORS SCHERING CORPORATION (US) 2008-10-08 EP disclosed
US-20070197581-A1 Benzenesulfonyl-chromane, thiochromane, tetrahydronaphthalene and related gamma secretase inhibitors MERCK SHARP & DOHME LLC 2007-08-23 US disclosed
WO-2007084595-A2 CARBOCYCLIC AND HETEROCYCLIC ARYLSULFONES AS GAMMA SECRETASE INHIBITORS SCHERING CORPORATION (US) 2007-07-26 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 (2 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-20120264736-A1 BENZENESULFONYL-CHROMANE, THIOCHROMANE, TETRAHYDRONAPHTHALENE AND RELATED GAMMA SECRETASE INHIBITORS BACE1, PSEN1, BACE2 CYP3A4 567/4885MEN1 2915/4885POLB 3074/4885
US-20070197581-A1 Benzenesulfonyl-chromane, thiochromane, tetrahydronaphthalene and related gamma secretase inhibitors BACE1, BACE2, PSEN1 CYP3A4 593/4885MEN1 2849/4885POLB 3364/4885

“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.