SCHEMBL5233798

SCHEMBL5233798

CNC1(CC=O)CN(c2ccc(Br)cn2)CCCN1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.36
PANK3 Q9H999 1/20 0.36
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
TSHR P16473 3/20 0.33
ACACB O00763 1/20 0.32
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
CHRM4 P08173 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
HDAC1 Q13547 2/20 0.31
ALDH1A1 P00352 2/20 0.31
POLB P06746 1/20 0.31
AOC3 Q16853 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
SCHEMBL5234755 0.85 EGLN1 (0.39) RAB9A
SCHEMBL5238848 0.83 EGLN1 (0.42) TSHRACACBGRIN1GRIN2BTRPV1
SCHEMBL5238526 0.82 PANK3 (0.39) PANK3PPARGPPARAGRIN2DGRIN3B
SCHEMBL5237586 0.82 KDM4E (0.40) ALDH1A1POLBKDM4ESMN1; SMN2
SCHEMBL5237009 0.82 DGAT1 (0.39)
SCHEMBL5236962 0.81 EGLN1 (0.45)
SCHEMBL5236774 0.80 CACNA1G (0.39) PPARGPPARDPPARACHRM4TRPV1
SCHEMBL5237968 0.80 EGLN1 (0.47) KDM4EMAPK1SMN1; SMN2
SCHEMBL5233791 0.79 PANK3 (0.41) AKR1C3PANK3PPARGPPARDPPARA
SCHEMBL5233015 0.79 MGLL (0.42) GRIN1GRIN2B

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