SCHEMBL7359222

SCHEMBL7359222

CC1(C(=O)ON)CCCC1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 1/20 0.42
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.35
P2RX7 Q99572 1/20 0.33
MEN1 O00255 1/20 0.30
CYP3A4 P08684 1/20 0.30
KMT2A Q03164 1/20 0.30
CETP P11597 1/20 0.30

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
SCHEMBL7527879 0.98 ALDH1A1 (0.42) FFAR3ALDH1A1SMN1; SMN2NPSR1P2RX7
SCHEMBL17425036 0.95
SCHEMBL27537041 0.92
SCHEMBL7739592 0.77 ALDH1A1 (0.45) FFAR3ALDH1A1SMN1; SMN2NPSR1P2RX7
SCHEMBL17958 0.77 NPSR1 (0.52) FFAR3ALDH1A1SMN1; SMN2NPSR1P2RX7
SCHEMBL1439739 0.75 FFAR3 (0.42) FFAR3ALDH1A1SMN1; SMN2NPSR1P2RX7
SCHEMBL17852 0.75 NPSR1 (0.50) FFAR3ALDH1A1SMN1; SMN2NPSR1P2RX7
SCHEMBL14445398 0.75 NPSR1 (0.50) FFAR3ALDH1A1SMN1; SMN2NPSR1P2RX7
SCHEMBL8527912 0.75 FFAR3 (0.42) FFAR3ALDH1A1SMN1; SMN2NPSR1P2RX7
SCHEMBL28253114 0.75 FFAR3 (0.42) FFAR3ALDH1A1SMN1; SMN2NPSR1P2RX7

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-1147078-A1 ACETYLENIC (BETA)-SULFONAMIDO AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS American Cyanamid Company (US) 2001-10-24 EP disclosed
WO-2000044711-A1 ACETYLENIC $G(b)-SULFONAMIDO AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 WO disclosed