SCHEMBL6152350

SCHEMBL6152350

COC(=O)C(=Cc1c(Cl)cccc1Cl)C(=O)CCc1ccccc1COCCN1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.37
HRH3 Q9Y5N1 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.36
TSHR P16473 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
LTA4H P09960 1/20 0.35
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35

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
SCHEMBL6153618 0.82 CDYL (0.39) SMN1; SMN2HRH3TSHRKDM4ELMNA
SCHEMBL6152947 0.80 PLAAT3 (0.34) HPGDMEN1KMT2A
SCHEMBL6153271 0.80 PLAAT3 (0.34) HPGDMEN1KMT2A
SCHEMBL6161533 0.79 PLAAT3 (0.37) HPGDSMN1; SMN2KMT2ALMNAMAPT
SCHEMBL6161539 0.79 PLAAT3 (0.37) HPGDSMN1; SMN2KMT2ALMNAMAPT
SCHEMBL6153048 0.79 HPGD (0.34) HPGD
SCHEMBL6153049 0.79 HPGD (0.34) HPGD
SCHEMBL6152351 0.77 L3MBTL1 (0.41) HPGDSMN1; SMN2HRH3L3MBTL1KDM4E
SCHEMBL6153056 0.76 BACE1 (0.40) HPGDTSHRMEN1KMT2ALMNA
SCHEMBL6153057 0.76 BACE1 (0.40) HPGDTSHRMEN1KMT2ALMNA

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-1307449-B1 1,4-DIHYDROPYRIDINES AS BRADYKININ ANTAGONISTS PFIZER PHARMA (JP) 2005-12-07 EP disclosed