SCHEMBL11711213

SCHEMBL11711213

COc1cccc(C(=O)NCCc2ccc(-c3ccc(O)cc3)cc2)c1OC

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.60
▸ NPC1 O15118 2/20 0.59
▸ RAB9A P51151 2/20 0.59
▸ ALDH1A1 P00352 1/20 0.59
▸ SMN1; SMN2 Q16637 1/20 0.59
▸ DNMT3A Q9Y6K1 1/20 0.58
▸ ADORA2A P29274 1/20 0.57
▸ ADORA2B P29275 1/20 0.57
▸ KDM4E B2RXH2 1/20 0.55
▸ TAAR1 Q96RJ0 1/20 0.53
▸ ATM Q13315 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ NAMPT P43490 1/20 0.49
▸ USP2 O75604 1/20 0.49
▸ MT-CO2 P00403 1/20 0.49
▸ CNR2 P34972 2/20 0.48
▸ SLC6A5 Q9Y345 1/20 0.47
▸ KMT2A Q03164 1/20 0.47

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
SCHEMBL11684013 0.89 DNMT3A (0.65) HPGDNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL11705608 0.85 TAAR1 (0.73) NPC1RAB9ADNMT3AADORA2AADORA2B
SCHEMBL11683949 0.83 KDM4E (0.58) HPGDNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL30686690 0.80 HPGD (0.78) HPGDNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL26936103 0.80 HPGD (0.78) HPGDNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL5321712 0.80 DNMT3A (0.69) NPC1RAB9ASMN1; SMN2DNMT3AADORA2A
SCHEMBL11708524 0.80 ALDH1A1 (0.48) HPGDNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL26936102 0.79 HPGD (0.86) HPGDNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL11706215 0.79 ALDH1A1 (0.65) HPGDNPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL26922278 0.78 HPGD (0.84) HPGDNPC1RAB9AALDH1A1SMN1; SMN2

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
US-4010279-A BIPHENYLOXY DERIVATIVES AND ANTIHYPERLIPIDEMIC USE BOEHRINGER INGELHEIM GMBH (DT) 1977-03-01 — — US disclosed
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