SCHEMBL2911908

SCHEMBL2911908

ClCc1cccc(C2CC2)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.45
TSHR P16473 1/20 0.40
HTR2C P28335 4/20 0.39
DRD3 P35462 2/20 0.39
DRD1 P21728 1/20 0.39
DRD4 P21917 1/20 0.39
DRD5 P21918 1/20 0.39
CYP3A4 P08684 1/20 0.38
SLC5A1 P13866 1/20 0.38
SLC5A2 P31639 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
MRGPRX4 Q96LA9 2/20 0.38
OPRM1 P35372 1/20 0.37
OPRL1 P41146 1/20 0.37
KMO O15229 1/20 0.37
NOTUM Q6P988 1/20 0.36

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
SCHEMBL5958348 0.90 KMO (0.49) DRD2TSHRDRD3DRD1DRD4
SCHEMBL23662671 0.81 PRMT5 (0.39) DRD2TSHRDRD3DRD1DRD4
SCHEMBL29866165 0.81 PRMT5 (0.39) DRD2TSHRDRD3DRD1DRD4
SCHEMBL18640667 0.79 DRD2 (0.41) DRD2TSHRHTR2CDRD3DRD1
SCHEMBL16957589 0.79 DRD2 (0.55) DRD2TSHRHTR2CDRD3DRD1
SCHEMBL22805478 0.79 SIGMAR1 (0.47) DRD2HTR2CDRD3DRD1DRD4
SCHEMBL2918150 0.79 DRD2 (0.41) DRD2HTR2CDRD3DRD1DRD4
SCHEMBL17986245 0.79 HDAC4 (0.42) DRD2HTR2CDRD3DRD1DRD4
SCHEMBL3176710 0.79 PNMT (0.47) DRD2
SCHEMBL30125100 0.79 DRD2 (0.41) DRD2TSHRHTR2CDRD3DRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1989194-B1 CYCLIC SULFONES USEFUL AS BACE INHIBITORS NOVARTIS AG (CH) 2010-08-25 EP disclosed
US-20090099207-A1 Cyclic sulfones useful as BACE inhibitors RUEEGER HEINRICH 2009-04-16 US disclosed
CN-101384580-A Cyclic sulfones useful as BACE inhibitors NOVARTIS AG (CH) 2009-03-11 CN 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-20090099207-A1 Cyclic sulfones useful as BACE inhibitors BACE1, BACE2, APP DRD2 4134/4885TSHR 4711/4885HTR2C 4178/4885

“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.