SCHEMBL9347887

SCHEMBL9347887

CCCc1ccc(CN(Cc2ccc(CCC)cc2)c2ccc(C(=O)Nc3ccccc3OCCCC(=O)OCC)c(C)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRD5A2 P31213 1/20 0.40
▸ POLB P06746 3/20 0.40
▸ TSHR P16473 2/20 0.40
▸ PTPN1 P18031 2/20 0.40
▸ GAA P10253 2/20 0.39
▸ MAPT P10636 3/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ HTT P42858 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ HPGD P15428 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ SENP8 Q96LD8 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ MRGPRX1 Q96LB2 2/20 0.37
▸ ABCG2 Q9UNQ0 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37

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
SCHEMBL9347880 0.91 SRD5A2 (0.49) SRD5A2POLBTSHRPTPN1GAA
SCHEMBL9351284 0.86 SRD5A2 (0.46) SRD5A2POLBTSHRPTPN1NPSR1
SCHEMBL9347892 0.84 SRD5A2 (0.48) SRD5A2POLBTSHRPTPN1GAA
SCHEMBL9348893 0.84 DHFR (0.43) SRD5A2POLBTSHRPTPN1GAA
SCHEMBL9347554 0.82 SRD5A2 (0.47) SRD5A2POLBTSHRPTPN1GAA
SCHEMBL9351846 0.80 SRD5A2 (0.63) SRD5A2TSHRPTPN1MAPTL3MBTL1
SCHEMBL9347913 0.80 SRD5A2 (0.48) SRD5A2HTTALDH1A1HPGD
SCHEMBL9347859 0.80 SRD5A2 (0.56) SRD5A2
SCHEMBL9348976 0.79 GAA (0.51) SRD5A2POLBTSHRGAASENP8
SCHEMBL9347519 0.79 GAA (0.55) SRD5A2POLBTSHRPTPN1GAA

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 disclosed
US-4935240-A Benzoylaminophenoxybutanoic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1990-06-19 — — US disclosed
EP-0294035-A2 Benzoylaminophenoxybutanoic acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1988-12-07 — — EP disclosed
Send feedback