SCHEMBL2231121

SCHEMBL2231121

CN(C)Cc1ccc(OCCC2CCN(C(=O)OCc3cncs3)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 9/20 0.43
CYP3A4 P08684 2/20 0.43
GPR119 Q8TDV5 5/20 0.41
LTA4H P09960 1/20 0.40
FAAH O00519 1/20 0.40
PARP15 Q460N3 1/20 0.39
PARP10 Q53GL7 1/20 0.39
TEAD1 P28347 1/20 0.39
TEAD3 Q99594 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
SCHEMBL2226508 0.87 FAAH (0.47) GRIN2BCYP3A4LTA4HFAAHTEAD1
SCHEMBL2229249 0.87 PARP15 (0.43) GRIN2BGPR119LTA4HFAAHPARP15
SCHEMBL2227860 0.87 GRIN2B (0.47) GRIN2BCYP3A4GPR119LTA4HFAAH
SCHEMBL2227775 0.87 LMNA (0.47) GRIN2BCYP3A4GPR119LTA4HFAAH
SCHEMBL2226276 0.87 TEAD1 (0.53) GRIN2BCYP3A4FAAHTEAD1TEAD3
SCHEMBL2365329 0.86 FAAH (0.50) GRIN2BCYP3A4FAAHTEAD1TEAD3
SCHEMBL2363076 0.86 GPR119 (0.44) GRIN2BCYP3A4GPR119FAAHPARP15
SCHEMBL2231080 0.85 GPR119 (0.56) GPR119
SCHEMBL2230054 0.85 PARP15 (0.58) GRIN2BGPR119FAAHPARP15PARP10
SCHEMBL2228411 0.85 TEAD1 (0.49) GRIN2BCYP3A4FAAHPARP15PARP10

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 8 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
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 362/4885CYP3A4 724/4885GPR119 242/4885

“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.