SCHEMBL2291228

SCHEMBL2291228

O=C(OCc1cncs1)N1CCC(CCOc2ccc(F)cc2-c2cc[nH]n2)CC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 3/20 0.38
MGLL Q99685 3/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NPY5R Q15761 1/20 0.35
RAB9A P51151 2/20 0.34
PTGDR2 Q9Y5Y4 3/20 0.34
ENPP2 Q13822 2/20 0.34
NPC1 O15118 1/20 0.34
CYP3A4 P08684 1/20 0.33
CHRM4 P08173 1/20 0.33
IDO1 P14902 1/20 0.33
SCN9A Q15858 1/20 0.33

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
SCHEMBL2227353 0.84 GRIN2B (0.41) GRIN2BMGLLMEN1KMT2ARAB9A
SCHEMBL2227860 0.81 GRIN2B (0.47) GRIN2BMEN1KMT2ACYP3A4CHRM4
SCHEMBL2228311 0.80 FAAH (0.44) GRIN2BRAB9ACYP3A4CHRM4IDO1
SCHEMBL2229121 0.78 GRIN2B (0.42) GRIN2BMEN1KMT2ARAB9ANPC1
SCHEMBL2231163 0.78 GRM5 (0.48) MEN1KMT2ARAB9AENPP2NPC1
SCHEMBL2229413 0.78 GPR119 (0.46) GRIN2BMGLLRAB9AENPP2CHRM4
SCHEMBL2228770 0.77 GRIN2B (0.43) GRIN2BCYP3A4CHRM4
SCHEMBL2229870 0.77 PTGDR2 (0.42) GRIN2BMEN1KMT2ARAB9APTGDR2
SCHEMBL2365346 0.77 GRIN2B (0.49) GRIN2BMEN1KMT2ARAB9ANPC1
SCHEMBL2228127 0.77 GRM5 (0.41) KMT2ARAB9AENPP2NPC1CYP3A4

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 GRIN2B 362/4885MGLL 4793/4885MEN1 880/4885

“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.