SCHEMBL345079

SCHEMBL345079

CCOC(=O)c1cc(C(OC(=O)NCC2(F)CCNCC2)c2ccc3cc(Cl)ccc3n2)on1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.36
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
POLB P06746 1/20 0.33
THRB P10828 1/20 0.33
ALOX15 P16050 1/20 0.32
KCNH2 Q12809 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32
ACR P10323 1/20 0.32
MAPK1 P28482 2/20 0.31
ALDH1A1 P00352 1/20 0.31
ANO1 Q5XXA6 1/20 0.31
LMNA P02545 1/20 0.31
ADORA2A P29274 1/20 0.31
PTPN1 P18031 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
ADORA2B P29275 1/20 0.31

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
SCHEMBL2327815 0.91 CHRM1 (0.36) CHRM1CHRM3
SCHEMBL344924 0.77 SYK (0.35) L3MBTL1THRBALDH1A1
SCHEMBL345077 0.72 HTR3A (0.39) MAPTL3MBTL1POLBKCNH2HRH3
SCHEMBL345078 0.69 L3MBTL1 (0.34) MAPTL3MBTL1POLBALOX15KCNH2
Trifluoroacetic Acid SCHEMBL345531 0.68 KMT2A (0.34) MAPTPOLBALDH1A1
SCHEMBL2331289 0.67 IRAK4 (0.33)
SCHEMBL2327811 0.62 HRH3 (0.39) MAPTHRH3MAPK1ALDH1A1LMNA
SCHEMBL2324598 0.60 CHRM1 (0.35) CHRM1CHRM3POLB
SCHEMBL8512521 0.60 MAPT (0.36) MAPTPOLBTHRBALDH1A1RXFP1
SCHEMBL8512517 0.60 MAPT (0.36) MAPTPOLBTHRBALDH1A1RXFP1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8716289-B2 Carbamate derivatives of alkyl-heterocycles, preparation thereof and therapeutic use thereof SANOFI (FR) 2014-05-06 US disclosed
US-20120015950-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2012-01-19 US 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-20120015950-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF INTS9, CDK8, SCN8A MAPT 4026/4885CHRM1 308/4885CHRM3 566/4885

“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.