SCHEMBL2286453

SCHEMBL2286453

O=C(OCc1cncs1)N1CCC(CCOc2ccc3cc[nH]c3c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 3/20 0.39
LTA4H P09960 1/20 0.38
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
CYP3A4 P08684 2/20 0.37
PPARD Q03181 1/20 0.37
GPR119 Q8TDV5 3/20 0.37
GHSR Q92847 1/20 0.37
GRIN2B Q13224 4/20 0.36
TSHR P16473 1/20 0.36
PARP15 Q460N3 1/20 0.36
PARP10 Q53GL7 1/20 0.36
TEAD1 P28347 1/20 0.36
TEAD3 Q99594 1/20 0.36
PDE1C Q14123 1/20 0.35

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
SCHEMBL2227973 0.88 TEAD1 (0.41) CYP3A4GPR119GRIN2BTEAD1TEAD3
SCHEMBL2230319 0.86 GRIN2B (0.44) CHEK2CYP3A4GPR119GRIN2BTSHR
SCHEMBL2228298 0.86 CYP3A4 (0.39) CYP3A4GPR119GRIN2BPARP15PARP10
SCHEMBL2228211 0.84 LMNA (0.41) CYP3A4GRIN2B
SCHEMBL2229765 0.84 CHRM4 (0.39) CHEK2CYP3A4GPR119GRIN2BPARP15
SCHEMBL2229981 0.84 CHEK2 (0.39) CHEK2CYP3A4PPARDGPR119GRIN2B
SCHEMBL2227775 0.83 LMNA (0.47) LTA4HCYP3A4GPR119GRIN2BPARP15
SCHEMBL2227860 0.83 GRIN2B (0.47) LTA4HCYP3A4GPR119GRIN2BPARP15
SCHEMBL2226276 0.83 TEAD1 (0.53) CYP3A4GRIN2BTEAD1TEAD3
SCHEMBL2229063 0.83 GPR119 (0.41) CYP3A4GPR119GRIN2BTEAD1TEAD3

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 CHEK2 3802/4885LTA4H 4158/4885DRD2 1234/4885

“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.