SCHEMBL3770074

SCHEMBL3770074

CCOC(=O)C(C)(C)S(=O)(=O)N(CC)OCC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.34
CYP4A11 Q02928 3/20 0.34
PKM P14618 3/20 0.33
MMP8 P22894 2/20 0.33
PIN1 Q13526 1/20 0.33
MAPK1 P28482 1/20 0.32
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
CHRM5 P08912 1/20 0.32
CHRM1 P11229 1/20 0.32
CHRM3 P20309 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 2/20 0.31
ABCB11 O95342 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
TSHR P16473 1/20 0.31
HTR2A P28223 1/20 0.31

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
SCHEMBL3781135 0.82
SCHEMBL3783953 0.78 GAA (0.39) CYP4F2CYP4A11PKMMMP8PIN1
SCHEMBL3781229 0.74 ALDH1A1 (0.42) CYP4F2CYP4A11PKMMMP8PIN1
SCHEMBL1620933 0.71 CYP4F2 (0.41) CYP4F2CYP4A11PKMMMP8PIN1
SCHEMBL13232097 0.71 CYP4F2 (0.41) CYP4F2CYP4A11PKMMMP8PIN1
SCHEMBL1621367 0.71 ALOX15 (0.42) CYP4F2CYP4A11PKMMMP8PIN1
SCHEMBL3782800 0.70 CYP4F2 (0.36) CYP4F2CYP4A11PKMMMP8PIN1
SCHEMBL1621557 0.70 CYP4F2 (0.40) CYP4F2CYP4A11PKMMMP8PIN1
SCHEMBL1621562 0.67 MMP8 (0.43) CYP4F2CYP4A11PKMMMP8PIN1
SCHEMBL1621564 0.67 CYP4F2 (0.38) CYP4F2CYP4A11PKMMMP8PIN1

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
US-8546563-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-01 US disclosed
EP-2217565-B1 COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INT (DE) 2013-05-22 EP disclosed
US-20100331304-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-12-30 US 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-20100331304-A1 Compounds Which Modulate The CB2 Receptor CNR2, CNR1, OPRL1 CYP4F2 1284/4885CYP4A11 495/4885PKM 3550/4885

“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.