SCHEMBL2227489

SCHEMBL2227489

CCCCOc1cccc(OCCC2CCN(C(=O)OCc3cscn3)CC2)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
GPR119 Q8TDV5 8/20 0.42
TEAD1 P28347 1/20 0.41
TEAD3 Q99594 1/20 0.41
MET P08581 1/20 0.40
GRIN2B Q13224 4/20 0.39
PTGES O14684 1/20 0.39
ALOX5 P09917 1/20 0.39
P2RY12 Q9H244 1/20 0.38
HPGD P15428 1/20 0.38
FAAH O00519 1/20 0.38
CACNA1B Q00975 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
SCHEMBL2363762 0.91 GPR119 (0.47) MMP2MMP9GPR119TEAD1TEAD3
SCHEMBL2228538 0.89 TEAD1 (0.45) MMP2MMP9TEAD1TEAD3GRIN2B
SCHEMBL2365563 0.88 MMP2 (0.40) MMP2MMP9GPR119TEAD1TEAD3
SCHEMBL2229435 0.87 TEAD1 (0.45) MMP2MMP9TEAD1TEAD3GRIN2B
SCHEMBL2229045 0.87 MMP2 (0.45) MMP2MMP9GPR119TEAD1TEAD3
SCHEMBL2229801 0.86 KMT2A (0.47) MMP2MMP9TEAD1TEAD3FAAH
SCHEMBL2227230 0.86 GRIN2B (0.44) MMP2MMP9GPR119GRIN2BHPGD
SCHEMBL2228891 0.86 TEAD1 (0.50) MMP2MMP9GPR119TEAD1TEAD3
SCHEMBL2227170 0.86 MGLL (0.50) MMP2MMP9TEAD1TEAD3FAAH
SCHEMBL2230299 0.85 MEN1 (0.41) 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 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 MMP2 2880/4885MMP9 522/4885GPR119 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.