SCHEMBL4474249

SCHEMBL4474249

O=S(=O)(c1ccccc1)N1CCN(Cc2ccc(-c3ccccc3C(F)(F)F)cc2)CC1c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.59
ALDH1A1 P00352 4/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45
KDM4E B2RXH2 2/20 0.44
RECQL P46063 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
TACR1 P25103 1/20 0.41
NR1H2 P55055 5/20 0.40
NR1H3 Q13133 5/20 0.40
ATM Q13315 1/20 0.40
KDM2B Q8NHM5 1/20 0.39

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
SCHEMBL4481096 0.89 CNR2 (0.60) CNR2ALDH1A1KMT2AKDM4ETDP1
SCHEMBL4465870 0.86 CNR2 (0.54) CNR2ALDH1A1RAB9AKMT2AKDM4E
SCHEMBL4472814 0.86 CNR2 (0.62) CNR2ALDH1A1KMT2AKDM4ETDP1
SCHEMBL13708833 0.85 CNR2 (0.53) CNR2ALDH1A1KMT2AKDM4ERECQL
SCHEMBL4476107 0.81 CNR2 (0.66) CNR2ALDH1A1KMT2AKDM4ETDP1
SCHEMBL4468418 0.80 CNR2 (0.64) CNR2ALDH1A1KMT2AKDM4ETDP1
SCHEMBL4489036 0.80 CNR2 (0.64) CNR2ALDH1A1KMT2AKDM4ETDP1
SCHEMBL4483088 0.79 CNR2 (0.60) CNR2ALDH1A1KMT2AKDM4ETDP1
SCHEMBL4473174 0.79 CNR2 (0.59) CNR2ALDH1A1RAB9AKMT2AKDM4E
SCHEMBL4480824 0.78 CNR2 (0.59) CNR2ALDH1A1KMT2AKDM4ETDP1

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-20070191340-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-08-16 US claimed
US-7595397-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-09-29 US disclosed
US-7595397-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-09-29 US disclosed
US-7595397-B2 Compounds which modulate the CB2 receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-09-29 US disclosed
EP-1966132-A2 COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-09-10 EP disclosed
US-20070191340-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-08-16 US disclosed
US-20070191340-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-08-16 US disclosed
US-20070191340-A1 Compounds Which Modulate The CB2 Receptor BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-08-16 US disclosed
WO-2007070760-A2 COMPOUNDS WHICH MODULATE THE CB2 RECEPTOR BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-06-21 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-20070191340-A1 Compounds Which Modulate The CB2 Receptor CNR1, CNR2, ARRB1 CNR2 2/4885ALDH1A1 2612/4885RAB9A 1484/4885

“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.