SCHEMBL4726408

SCHEMBL4726408

COC(=O)C1(C(=O)Cl)CCCCC1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.45
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 1/20 0.39
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
CYP3A4 P08684 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32

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
SCHEMBL30816804 0.98 NPSR1 (0.47) NPSR1ALDH1A1L3MBTL1MAPTCYP4F2
SCHEMBL2141041 0.93 NPSR1 (0.42) NPSR1ALDH1A1L3MBTL1MAPTCYP4F2
SCHEMBL668965 0.89 NPSR1 (0.40) NPSR1ALDH1A1L3MBTL1MAPTCYP4F2
SCHEMBL9806699 0.86 NPSR1 (0.52) NPSR1ALDH1A1L3MBTL1MAPTCYP4F2
SCHEMBL4870814 0.86 NPSR1 (0.52) NPSR1ALDH1A1L3MBTL1MAPTCYP4F2
SCHEMBL594374 0.86 NPSR1 (0.52) NPSR1ALDH1A1L3MBTL1MAPTCYP4F2
SCHEMBL759802 0.84 NPSR1 (0.54) NPSR1ALDH1A1L3MBTL1MAPTCYP4F2
SCHEMBL11378256 0.83 NPSR1 (0.42) NPSR1ALDH1A1L3MBTL1MAPTCYP4F2
Ethylene SCHEMBL11214910 0.82 NPSR1 (0.48) NPSR1ALDH1A1L3MBTL1MAPTCYP4F2
SCHEMBL9806701 0.80 NPSR1 (0.47) NPSR1ALDH1A1L3MBTL1MAPTCYP4F2

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
CN-101166734-A Novel aminopyridine compounds having Syk inhibitory activity JAPAN TOBACCO INC (JP) 2008-04-23 CN disclosed
WO-2008011130-A2 AMIDE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-24 WO disclosed