SCHEMBL4708554

SCHEMBL4708554

CC(CNCc1ccccc1NC(=O)O)C1CC1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
KMT2A Q03164 3/20 0.41
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
CCR3 P51677 4/20 0.40
EPHX2 P34913 1/20 0.39
MEN1 O00255 2/20 0.38
KCNK3 O14649 1/20 0.38
KCNK9 Q9NPC2 1/20 0.38
GAA P10253 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
GPR119 Q8TDV5 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
SCHEMBL4705836 0.94 KMT2A (0.50) L3MBTL1KMT2AALDH1A1POLBEPHX2
SCHEMBL4706370 0.92 CXCR2 (0.39) L3MBTL1KMT2AALDH1A1POLBCCR3
SCHEMBL4708749 0.78 KMT2A (0.44) L3MBTL1KMT2AALDH1A1POLBKCNK3
SCHEMBL4759528 0.78 KMT2A (0.41) L3MBTL1KMT2AALDH1A1MEN1TAS1R3
SCHEMBL4709150 0.77 KDM4C (0.40) GAASMN1; SMN2
SCHEMBL4710745 0.77 GAA (0.38) KMT2AALDH1A1GAASMN1; SMN2
SCHEMBL4708837 0.77 KMT2A (0.44) L3MBTL1KMT2AALDH1A1POLBKCNK3
SCHEMBL4706438 0.77 F10 (0.40) TAS1R3TAS1R1GPR119
SCHEMBL4708259 0.77 SMN1; SMN2 (0.51) L3MBTL1KMT2AALDH1A1POLBMEN1
SCHEMBL4708567 0.77 KDM4E (0.46) KMT2AALDH1A1MEN1GAA

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
EP-1879877-A2 ANTIMICROBIAL AGENTS Ranbaxy Laboratories Limited (IN) 2008-01-23 EP disclosed
WO-2006117762-A2 ANTIMICROBIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2006-11-09 WO disclosed