SCHEMBL4570735

SCHEMBL4570735

CC1(S(=O)(=O)c2ccc(Cl)cc2)CCN(c2ccc(C(F)(F)F)cn2)C1=O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.50
GPR119 Q8TDV5 1/20 0.41
KDM4E B2RXH2 2/20 0.41
CXCR3 P49682 6/20 0.41
GAA P10253 1/20 0.40
CYP3A4 P08684 2/20 0.39
OPRM1 P35372 1/20 0.39
OPRL1 P41146 1/20 0.39
APAF1 O14727 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 0.37
PKM P14618 1/20 0.37

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
SCHEMBL1787389 0.73 CNR2 (0.43) ALDH1A1MAPTSMN1; SMN2
SCHEMBL5335588 0.70 L3MBTL1 (0.91) L3MBTL1GPR119KDM4EGAACYP3A4
SCHEMBL4570728 0.70 EEF2K (0.45) KDM4EGAACYP3A4ALDH1A1MAPT
SCHEMBL4570738 0.69 CNR2 (0.36) GAAALDH1A1MAPTSMN1; SMN2
SCHEMBL4570737 0.69 CNR2 (0.36) GAAALDH1A1MAPTSMN1; SMN2
SCHEMBL1785466 0.69 CNR2 (0.36) GAAALDH1A1MAPTSMN1; SMN2
SCHEMBL3207424 0.68 L3MBTL1 (0.63) L3MBTL1GPR119KDM4EGAACYP3A4
Hydrochloric Acid SCHEMBL30328535 0.68 OPRM1 (0.43) L3MBTL1KDM4EGAAOPRM1OPRL1
SCHEMBL1464996 0.66 MAPT (0.54) GAACYP3A4ALDH1A1MAPT
SCHEMBL4570736 0.66 NEK2 (0.37) L3MBTL1KDM4EGAAALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2326629-B1 SULFONE COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INT (DE) 2013-10-02 EP disclosed
US-8178568-B2 Sulfone compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-15 US disclosed
US-8178568-B2 Sulfone compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-15 US disclosed
US-20110124696-A1 Sulfone Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-05-26 US disclosed
US-20110124696-A1 Sulfone Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-05-26 US disclosed
WO-2010005782-A1 SULFONE COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-01-14 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-20110124696-A1 Sulfone Compounds Which Modulate The CB2 Receptor CNR2, CNR1, TRPV1 L3MBTL1 4584/4885GPR119 158/4885KDM4E 2157/4885

“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.