SCHEMBL9294167

SCHEMBL9294167

NCC1CCCCC(C(=O)O)C1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
PLG P00747 1/20 0.57
PLAT P00750 1/20 0.57
ANPEP P15144 1/20 0.53
CYP2D6 P10635 1/20 0.47
GABRR1 P24046 5/20 0.43
GABRR2 P28476 1/20 0.43
GRM2 Q14416 1/20 0.41
GRM3 Q14832 1/20 0.41
EPHX1 P07099 1/20 0.38
PEPD P12955 1/20 0.38
SLC6A4 P31645 1/20 0.37
SLC6A1 P30531 2/20 0.36
SLC6A11 P48066 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SLC6A13 Q9NSD5 1/20 0.36
CES2 O00748 1/20 0.36
CES1 P23141 1/20 0.36
ALOX5 P09917 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
SCHEMBL30484839 0.96 LMNA (0.57) LMNAPLGPLATANPEPCYP2D6
SCHEMBL5503267 0.96 LMNA (0.57) LMNAPLGPLATANPEPCYP2D6
SCHEMBL9504271 0.96 LMNA (0.57) LMNAPLGPLATANPEPCYP2D6
SCHEMBL3282964 0.96 LMNA (0.57) LMNAPLGPLATANPEPCYP2D6
SCHEMBL5503262 0.96 LMNA (0.57) LMNAPLGPLATANPEPCYP2D6
SCHEMBL9504278 0.96 LMNA (0.57) LMNAPLGPLATANPEPCYP2D6
SCHEMBL5722332 0.87 LMNA (0.75) LMNAPLGPLATANPEPCYP2D6
SCHEMBL4350693 0.87 LMNA (0.75) LMNAPLGPLATANPEPCYP2D6
SCHEMBL1965494 0.87 LMNA (0.75) LMNAPLGPLATANPEPCYP2D6
SCHEMBL28816390 0.87 LMNA (0.75) LMNAPLGPLATANPEPCYP2D6

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
US-RE34722-E Antiulcer agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-06 US disclosed
US-4578381-A ANTIULCER AGENTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-03-25 US disclosed