SCHEMBL2229065

SCHEMBL2229065

O=C(OCc1cncs1)N1CCC(CCOc2ccccc2C2CCCC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.40
GRIN2B Q13224 9/20 0.39
FAAH O00519 1/20 0.39
CHRM4 P08173 1/20 0.39
CYP2D6 P10635 3/20 0.39
CYP2C9 P11712 3/20 0.39
CYP3A4 P08684 2/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
IDO1 P14902 2/20 0.38
RBP4 P02753 2/20 0.38
HTR1D P28221 1/20 0.37
HTR1B P28222 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
SCHEMBL2228770 0.86 GRIN2B (0.43) GRIN2BFAAHCHRM4CYP2D6CYP2C9
SCHEMBL2228311 0.85 FAAH (0.44) GRIN2BFAAHCHRM4CYP2D6CYP2C9
SCHEMBL2365346 0.85 GRIN2B (0.49) GRIN2BFAAHCHRM4CYP2D6CYP2C9
SCHEMBL2229709 0.85 LMNA (0.48) GRIN2BFAAHCHRM4CYP2D6CYP2C9
SCHEMBL2226276 0.84 TEAD1 (0.53) GRIN2BFAAHCHRM4CYP2D6CYP2C9
SCHEMBL2227965 0.84 CHRM4 (0.42) GRIN2BFAAHCHRM4CYP2D6CYP2C9
SCHEMBL2226191 0.83 GRIN2B (0.45) GRIN2BFAAHCHRM4CYP2D6CYP2C9
SCHEMBL2229166 0.83 PTGDR2 (0.40) PTGDR2GRIN2BFAAHCHRM4CYP2D6
SCHEMBL2228348 0.83 HTT (0.39) GRIN2BFAAHCHRM4CYP2D6CYP2C9
SCHEMBL2365447 0.82 POLB (0.39) GRIN2BFAAHCHRM4CYP2D6CYP2C9

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 7 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
US-9000010-B2 Alkyl-heterocycle carbamate derivatives, their preparation and their therapeutic application SANOFI (FR) 2015-04-07 US 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 PTGDR2 1454/4885GRIN2B 362/4885FAAH 1562/4885

“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.