SCHEMBL21242857

SCHEMBL21242857

O=C(Nc1ccc(C(O)O)cc1)C1CCCC1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 3/20 0.67
HPGD P15428 1/20 0.62
NPSR1 Q6W5P4 3/20 0.56
RAB9A P51151 1/20 0.56
LMNA P02545 4/20 0.55
NAMPT P43490 1/20 0.54
MAPT P10636 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
ALDH1A1 P00352 1/20 0.52
STS P08842 1/20 0.52
PTPN2 P17706 1/20 0.52
ENPP3 O14638 1/20 0.52
ENPP1 P22413 1/20 0.52
GAA P10253 1/20 0.51
GFER P55789 1/20 0.51

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
SCHEMBL28656982 0.85 PTPN1 (0.89) PTPN1HPGDNPSR1RAB9ALMNA
SCHEMBL125695 0.85 PTPN1 (0.89) PTPN1HPGDNPSR1RAB9ALMNA
SCHEMBL19185753 0.85 GAA (0.68) PTPN1HPGDNPSR1RAB9ALMNA
SCHEMBL12545585 0.83 PTPN1 (0.68) PTPN1HPGDNPSR1RAB9ALMNA
SCHEMBL25647118 0.83 PTPN1 (0.68) PTPN1HPGDNPSR1RAB9ALMNA
SCHEMBL12975171 0.81 GAA (0.72) PTPN1HPGDNPSR1RAB9ALMNA
SCHEMBL24645052 0.79 NPSR1 (0.69) PTPN1NPSR1RAB9ALMNANAMPT
SCHEMBL9198985 0.79 PTPN1 (0.71) PTPN1HPGDNPSR1RAB9ALMNA
SCHEMBL62827 0.79 PTPN1 (0.71) PTPN1HPGDNPSR1RAB9ALMNA
SCHEMBL4448787 0.79 PTPN1 (0.71) PTPN1HPGDNPSR1RAB9ALMNA

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-3049388-B1 NUCLEATING AGENT FOR THERMOPLASTIC POLYMER COMPOSITION MILLIKEN & CO (US) 2019-08-07 EP disclosed