SCHEMBL9347607

SCHEMBL9347607

CCCc1ccc(COc2ccc(C(=O)Nc3ccccc3OCCCC(=O)O)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SENP7 Q9BQF6 2/20 0.66
SENP8 Q96LD8 1/20 0.66
SENP6 Q9GZR1 1/20 0.66
ADRA1D P25100 5/20 0.54
ADRA1A P35348 5/20 0.54
ADRA1B P35368 5/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
GAA P10253 2/20 0.53
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
CASP3 P42574 1/20 0.53
TAAR1 Q96RJ0 1/20 0.53
HDAC1 Q13547 2/20 0.52
HDAC2 Q92769 1/20 0.52
PLK1 P53350 1/20 0.52
ABCG2 Q9UNQ0 1/20 0.52
TP53 P04637 1/20 0.50
MAPT P10636 1/20 0.50
CACNA1H O95180 1/20 0.49
CACNA1B Q00975 1/20 0.49

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
SCHEMBL9348945 0.92 PPARA (0.58) SENP7SENP8SENP6ADRA1DADRA1A
SCHEMBL9351304 0.91 SMN1; SMN2 (0.63) SENP7ADRA1DADRA1AADRA1BSMN1; SMN2
SCHEMBL9347844 0.90 ADRA1D (0.56) SENP7SENP8SENP6ADRA1DADRA1A
SCHEMBL9347560 0.87 ADRA1D (0.56) SENP7SENP8SENP6ADRA1DADRA1A
SCHEMBL9347493 0.87 SRD5A2 (0.60) SENP7SENP8SENP6ADRA1DADRA1A
SCHEMBL9347842 0.87 ADRA1D (0.56) SENP7SENP8SENP6ADRA1DADRA1A
SCHEMBL9347863 0.86 GAA (0.53) SENP7SENP8SENP6ADRA1DADRA1A
SCHEMBL1123204 0.85 SENP7 (0.65) SENP7SENP8SENP6SMN1; SMN2GAA
SCHEMBL1123323 0.85 PLK1 (0.64) SENP7SENP8SENP6SMN1; SMN2GAA
SCHEMBL9351817 0.85 ADRA1D (0.59) ADRA1DADRA1AADRA1BCACNA1HCACNA1B

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0294035-B1 Benzoylaminophenoxybutanoic acid derivatives ONO PHARMACEUTICAL CO (JP) 1994-08-31 EP claimed
US-4935240-A Benzoylaminophenoxybutanoic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1990-06-19 US claimed
EP-0294035-A2 Benzoylaminophenoxybutanoic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1988-12-07 EP claimed