SCHEMBL20236182

SCHEMBL20236182

CN1CCCN(C(=O)N(Cc2ccc(C(=O)O)cc2)c2ccccc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 3/20 0.53
LMNA P02545 1/20 0.50
CHRM1 P11229 2/20 0.46
TDP1 Q9NUW8 1/20 0.44
CHRM3 P20309 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CHKA P35790 1/20 0.44
POLB P06746 2/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
PTGES O14684 1/20 0.42
ALOX5 P09917 1/20 0.42
CHRM5 P08912 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL20236367 0.95 LTB4R2 (0.57) LTB4R2LMNACHRM1CHRM3POLB
SCHEMBL20236486 0.89 LTB4R2 (0.47) LTB4R2LMNAPOLBKMT2APTGES
SCHEMBL22218814 0.89 LTB4R2 (0.50) LTB4R2LMNACHRM1TDP1CHRM3
SCHEMBL22217880 0.89 HPGD (0.53) LTB4R2LMNACHRM1TDP1CHRM3
SCHEMBL20236474 0.89 LTB4R2 (0.50) LTB4R2LMNAPOLBKMT2AMEN1
SCHEMBL20236747 0.88 LTB4R2 (0.49) LTB4R2LMNAPOLBKMT2AMEN1
SCHEMBL20236767 0.84 KMT2A (0.55) LTB4R2LMNACHRM1KMT2AMEN1
SCHEMBL22217774 0.84 LTB4R2 (0.53) LTB4R2LMNACHRM1CHRM3CHKA
SCHEMBL20236221 0.84 LTB4R2 (0.53) LTB4R2LMNACHRM1POLBKMT2A
SCHEMBL20236120 0.83 LTB4R2 (0.60) LTB4R2CHRM1PTGESALOX5

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-3331864-A2 1,3,4-OXADIAZOLE DERIVATIVE COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND THE PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Chong Kun Dang Pharmaceutical Corp. (KR) 2018-06-13 EP disclosed