SCHEMBL2228875

SCHEMBL2228875

N#Cc1ccc(-c2ccc(OCCC3CCN(C(=O)OCc4cscn4)CC3)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 10/20 0.48
HRH1 P35367 10/20 0.48
HRH3 Q9Y5N1 8/20 0.48
MMP2 P08253 3/20 0.39
MMP9 P14780 1/20 0.39
GPR119 Q8TDV5 2/20 0.39
TEAD1 P28347 1/20 0.39
TEAD3 Q99594 1/20 0.39
ENPP2 Q13822 1/20 0.38
CHEK2 O96017 1/20 0.38

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
SCHEMBL2226384 0.97 HRH3 (0.43) HRH2HRH1HRH3MMP2MMP9
SCHEMBL2227846 0.93 HRH2 (0.44) HRH2HRH1HRH3MMP2MMP9
SCHEMBL2229979 0.90 MMP2 (0.41) HRH2HRH1HRH3MMP2MMP9
SCHEMBL2231117 0.90 TEAD1 (0.47) HRH2HRH1MMP2MMP9GPR119
SCHEMBL13837204 0.89 GRIN2B (0.43) HRH2HRH1MMP2MMP9GPR119
SCHEMBL2227170 0.88 MGLL (0.50) HRH2HRH1MMP2MMP9TEAD1
SCHEMBL2229112 0.86 GRM5 (0.43) HRH2HRH1HRH3MMP2MMP9
SCHEMBL2228850 0.86 GRIN2B (0.46) HRH2HRH1MMP2MMP9GPR119
SCHEMBL2229885 0.84 GPR119 (0.43) MMP2MMP9GPR119
SCHEMBL2365458 0.84 LIPE (0.43) MMP2MMP9GPR119TEAD1TEAD3

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
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
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 HRH2 345/4885HRH1 361/4885HRH3 54/4885

“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.