SCHEMBL5239869

SCHEMBL5239869

CNC1(CC=O)CN(c2ccc(-c3ccc(Cl)cc3Cl)cc2)CCN1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MARS1 P56192 6/20 0.36
SRD5A2 P31213 1/20 0.36
MCHR1 Q99705 1/20 0.35
RAB9A P51151 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
ATM Q13315 1/20 0.34
CNR1 P21554 2/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
USP30 Q70CQ3 1/20 0.34
MAPT P10636 2/20 0.34
TSHR P16473 1/20 0.34
HSD17B10 Q99714 1/20 0.34
EPHX2 P34913 1/20 0.34
BID P55957 1/20 0.33
BCL2A1 Q16548 1/20 0.33
PRKAB2 O43741 1/20 0.33
PRKAG1 P54619 1/20 0.33
PRKAA2 P54646 1/20 0.33

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
SCHEMBL5235446 0.89 ALDH1A1 (0.37) MEN1KMT2AHTTMAPTHSD17B10
SCHEMBL5239098 0.88 MEN1 (0.39) MEN1KMT2AHTTMAPTLMNA
SCHEMBL5231079 0.87 DGAT1 (0.39) MARS1MCHR1CNR1EPHX2
SCHEMBL5236743 0.83 ALDH1A1 (0.45) RAB9AMEN1KMT2AHTTNPSR1
SCHEMBL5235809 0.83 MAPT (0.44) RAB9AMEN1KMT2AHTTNPSR1
SCHEMBL5237009 0.83 DGAT1 (0.39) MARS1MCHR1CNR1EPHX2
SCHEMBL5236555 0.83 USP2 (0.41) MEN1KMT2AMAPTTSHRHSD17B10
SCHEMBL5236419 0.82 ADAMTS5 (0.39) KMT2AMAPT
SCHEMBL5232377 0.81 SMN1; SMN2 (0.37) RAB9AMEN1KMT2AATMHTT
SCHEMBL5234847 0.81 KMT2A (0.40) RAB9AMEN1KMT2AMAPTHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1701946-B1 DERIVATIVES OF 1-PIPERAZINE- AND 1-HOMOPIPERAZINE-CARBOXYLATES, PREPARATION METHOD THEREOF AND USE OF SAME AS INHIBITORS OF THE FAAH ENZYME SANOFI AVENTIS (FR) 2007-12-19 EP claimed