SCHEMBL345267

SCHEMBL345267

CNC(=O)c1cc(COC(=O)NCCC2CCN(c3ccc(-c4ccc(F)cc4)cc3)CC2)on1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
CHRM4 P08173 7/20 0.42
TSHR P16473 3/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
IKBKB O14920 1/20 0.40
CETP P11597 1/20 0.40
CHRM2 P08172 1/20 0.39
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.37
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 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
SCHEMBL345341 0.90 CHRM4 (0.42) CHRM4KMT2AMEN1MAPTPOLB
SCHEMBL343963 0.86 MEN1 (0.37) NPC1RAB9ACHRM4KMT2AMEN1
SCHEMBL345688 0.86 FFAR4 (0.39) CHRM4KMT2AMEN1CHRM2MAPT
SCHEMBL345088 0.83 PDE10A (0.44) KMT2AMEN1
SCHEMBL345122 0.79 CHRM4 (0.43) CHRM4KMT2AMEN1
SCHEMBL345285 0.79 CHRM4 (0.42) NPC1RAB9ACHRM4KMT2AMEN1
SCHEMBL346479 0.79 TSHR (0.42) NPC1RAB9ACHRM4TSHRLMNA
SCHEMBL345825 0.77 HRH3 (0.39) RAB9ACHRM4LMNAMAPT
SCHEMBL345713 0.77 SCN9A (0.39) NPC1RAB9ACHRM4
SCHEMBL345619 0.76 TDP1 (0.38) NPC1RAB9ACHRM4KMT2AMEN1

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 NPC1 1821/4885RAB9A 331/4885CHRM4 1210/4885

“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.