SCHEMBL345156

SCHEMBL345156

OCCC1(O)CCN(c2nccc(C(F)(F)F)n2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB1 P08588 1/20 0.56
RBP4 P02753 1/20 0.49
PKM P14618 2/20 0.46
SLC6A7 Q99884 1/20 0.46
KMT2A Q03164 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
KDM4E B2RXH2 2/20 0.42
LCAT P04180 1/20 0.42
OGA O60502 1/20 0.42
ALDH1A1 P00352 1/20 0.42
PARP1 P09874 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A4 P31645 2/20 0.41
SLC6A3 Q01959 2/20 0.41
RIPK1 Q13546 1/20 0.40
HTR2C P28335 3/20 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
SCHEMBL344004 0.89 ADRB1 (0.54) ADRB1RBP4PKMSLC6A7KMT2A
SCHEMBL2328205 0.84 ADRB1 (0.54) ADRB1RBP4PKMSLC6A7KMT2A
SCHEMBL2326691 0.83 ADRB1 (0.48) ADRB1RBP4PKMSLC6A7KMT2A
SCHEMBL8354208 0.79 ADRB1 (0.78) ADRB1RBP4PKMSLC6A7KMT2A
SCHEMBL344432 0.79 ADRB1 (0.44) ADRB1RBP4PKMSLC6A7KMT2A
SCHEMBL648827 0.77 ADRB1 (0.62) ADRB1RBP4PKMSLC6A7KMT2A
SCHEMBL15662899 0.76 RBP4 (0.45) ADRB1RBP4PKMCA12CA1
SCHEMBL13059857 0.76 ADRB1 (0.61) ADRB1RBP4PKMSLC6A7KMT2A
SCHEMBL28070992 0.76 ADRB1 (0.73) ADRB1RBP4PKMSLC6A7KMT2A
SCHEMBL3556451 0.74 ADRB1 (0.71) ADRB1RBP4PKMSLC6A7KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2356108-B1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-10-15 EP disclosed
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
CN-102216291-A Carbamate derivatives containing alkyl-heterocycles, preparation and therapeutic use thereof SANOFI AVENTIS 2011-10-12 CN disclosed
EP-2356108-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-08-17 EP disclosed
WO-2010055267-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2010-05-20 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-20120015950-A1 CARBAMATE DERIVATIVES OF ALKYL-HETEROCYCLES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF INTS9, CDK8, SCN8A ADRB1 1968/4885RBP4 2582/4885PKM 2791/4885

“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.