SCHEMBL2229776

SCHEMBL2229776

O=C(OCc1cscn1)N1CCC(CCOc2cc(Br)ccc2Cl)CC1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.39
PPARG P37231 1/20 0.39
PPARD Q03181 1/20 0.39
PPARA Q07869 1/20 0.39
ALDH1A1 P00352 1/20 0.38
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
ENPP2 Q13822 9/20 0.37
F10 P00742 1/20 0.36
CHRM4 P08173 2/20 0.35
MGLL Q99685 1/20 0.34
GRIN2B Q13224 1/20 0.34
FAAH O00519 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
SCHEMBL2229119 0.86 GRM5 (0.47) GRM5PPARGPPARDPPARAALDH1A1
SCHEMBL2227294 0.84 MGLL (0.43) GRM5ALDH1A1MMP2MMP9ENPP2
SCHEMBL2228778 0.83 HTT (0.41) GRM5PPARGPPARDPPARAALDH1A1
SCHEMBL2229236 0.82 GRIN2B (0.42) GRM5PPARGPPARDPPARAALDH1A1
SCHEMBL28088351 0.82 PPARG (0.40) GRM5PPARGPPARDPPARAALDH1A1
SCHEMBL2230651 0.82 GRIN2B (0.40) MMP2MMP9CHRM4MGLLGRIN2B
SCHEMBL2229112 0.81 GRM5 (0.43) GRM5ALDH1A1MMP2MMP9ENPP2
SCHEMBL2228092 0.80 GRM5 (0.41) GRM5PPARGPPARDPPARAENPP2
SCHEMBL2230184 0.80 GRIN2B (0.42) ALDH1A1MMP2MMP9GRIN2B
SCHEMBL2228993 0.80 KDM4E (0.44) MMP2MMP9CHRM4GRIN2BFAAH

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-9000010-B2 Alkyl-heterocycle carbamate derivatives, their preparation and their therapeutic application SANOFI (FR) 2015-04-07 US claimed
EP-2526100-B1 ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI SA (FR) 2013-12-04 EP claimed
CN-102803258-A Alkyl-heterocyclic carbamate derivatives, their preparation and therapeutic use SANOFI AVENTIS 2012-11-28 CN claimed
US-20120295909-A1 ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2012-11-22 US claimed
WO-2011089550-A1 ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI AVENTIS (FR) 2011-07-28 WO claimed
US-9000010-B2 Alkyl-heterocycle carbamate derivatives, their preparation and their therapeutic application SANOFI (FR) 2015-04-07 US disclosed
EP-2526100-B1 ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI SA (FR) 2013-12-04 EP disclosed
US-20120295909-A1 ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI (FR) 2012-11-22 US disclosed
WO-2011089550-A1 ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION SANOFI AVENTIS (FR) 2011-07-28 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-20120295909-A1 ALKYL-HETEROCYCLE CARBAMATE DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC APPLICATION PRMT9, PRMT8, CBR1 GRM5 124/4885PPARG 1206/4885PPARD 885/4885

“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.