SCHEMBL2825567

SCHEMBL2825567

O=C(Nc1ccc(F)cc1)N[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.61
RAB9A P51151 2/20 0.61
EPHX1 P07099 1/20 0.61
KMT2A Q03164 1/20 0.59
GFER P55789 1/20 0.55
EPHX2 P34913 5/20 0.55
KDM5B Q9UGL1 1/20 0.54
ATM Q13315 1/20 0.53
RCE1 Q9Y256 1/20 0.53
RECQL P46063 1/20 0.53
CCNK O75909 2/20 0.52
CCNA2 P20248 2/20 0.52
CDK2 P24941 2/20 0.52
CDK7 P50613 2/20 0.52
CCNH P51946 2/20 0.52
MNAT1 P51948 2/20 0.52
CDK12 Q9NYV4 2/20 0.52
PTPN1 P18031 1/20 0.52

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
SCHEMBL2825568 1.00 NPC1 (0.61) NPC1RAB9AEPHX1KMT2AGFER
SCHEMBL412447 0.85 NPC1 (0.62) NPC1RAB9AKMT2AGFEREPHX2
SCHEMBL10211627 0.81 EPHX1 (0.66) NPC1RAB9AEPHX1KMT2AEPHX2
SCHEMBL2825936 0.81 USP30 (0.64) NPC1RAB9AEPHX1EPHX2KDM5B
SCHEMBL2825935 0.81 USP30 (0.64) NPC1RAB9AEPHX1EPHX2KDM5B
SCHEMBL3961078 0.81 EPHX2 (0.65) NPC1RAB9AEPHX1KMT2AEPHX2
SCHEMBL192930 0.80 ALDH1A1 (0.69) RAB9APTPN1
SCHEMBL2752852 0.78 RAB9A (0.97) NPC1RAB9AEPHX1KMT2AEPHX2
SCHEMBL409828 0.78 NPC1 (0.56) NPC1RAB9AKMT2AGFEREPHX2
SCHEMBL4680830 0.77 PTPN1 (0.51) NPC1RAB9AKMT2AGFEREPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1893200-B1 CARBAMATE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMACEUTICALS SA (CH) 2010-09-29 EP claimed
US-20090082399-A1 Carbamate derivatives as positive allosteric modulators of metabotropic glutamate receptors ADDEX PHARMA SA (CH) 2009-03-26 US claimed
EP-1893200-A2 CARBAMATE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX Pharma S.A. (CH) 2008-03-05 EP claimed
WO-2006123244-A2 CARBAMATE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA SA (CH) 2006-11-23 WO claimed
EP-1893200-B1 CARBAMATE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMACEUTICALS SA (CH) 2010-09-29 EP disclosed
EP-1893200-B1 CARBAMATE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMACEUTICALS SA (CH) 2010-09-29 EP disclosed
US-20090082399-A1 Carbamate derivatives as positive allosteric modulators of metabotropic glutamate receptors ADDEX PHARMA SA (CH) 2009-03-26 US disclosed
US-20090082399-A1 Carbamate derivatives as positive allosteric modulators of metabotropic glutamate receptors ADDEX PHARMA SA (CH) 2009-03-26 US disclosed
US-20090082399-A1 Carbamate derivatives as positive allosteric modulators of metabotropic glutamate receptors ADDEX PHARMA SA (CH) 2009-03-26 US disclosed
EP-1893200-A2 CARBAMATE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX Pharma S.A. (CH) 2008-03-05 EP disclosed
WO-2006123244-A2 CARBAMATE DERIVATIVES AS POSITIVE ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA SA (CH) 2006-11-23 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-20090082399-A1 Carbamate derivatives as positive allosteric modulators of metabotropic glutamate receptors GRM5, GRIK5, GRM1 NPC1 2603/4885RAB9A 723/4885EPHX1 4156/4885

“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.