SCHEMBL6417786

SCHEMBL6417786

CC(=CCc1ccccc1C=CC(=O)c1ccccc1)CCC=C(CO)C(O)(O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 6/20 0.39
▸ RAB9A P51151 6/20 0.39
▸ MAPT P10636 6/20 0.39
▸ LMNA P02545 3/20 0.39
▸ BCHE P06276 2/20 0.39
▸ BACE1 P56817 1/20 0.38
▸ MAOB P27338 2/20 0.36
▸ PTGER4 P35408 2/20 0.36
▸ PTGER3 P43115 2/20 0.36
▸ PTGER2 P43116 2/20 0.36
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ HPGD P15428 3/20 0.35
▸ ATM Q13315 1/20 0.35
▸ PLIN1 O60240 1/20 0.35
▸ TNFRSF1A P19438 1/20 0.35
▸ ACHE P22303 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ PLIN5 Q00G26 1/20 0.35
▸ CYP1B1 Q16678 1/20 0.35
▸ ABHD5 Q8WTS1 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
SCHEMBL30739304 0.86 MAPT (0.45) NPC1RAB9AMAPTLMNABCHE
SCHEMBL27963663 0.86 MAPT (0.45) NPC1RAB9AMAPTLMNABCHE
SCHEMBL9369351 0.77 NPC1 (0.52) NPC1RAB9AMAPTLMNABCHE
SCHEMBL3307087 0.77 NPC1 (0.52) NPC1RAB9AMAPTLMNABCHE
SCHEMBL29396289 0.77 NPC1 (0.52) NPC1RAB9AMAPTLMNABCHE
SCHEMBL3275092 0.75 PTGER3 (0.53) MAPTLMNAPTGER4PTGER3PTGER2
SCHEMBL9789287 0.72 MAPT (0.49) NPC1RAB9AMAPTLMNABCHE
SCHEMBL7559547 0.70 RAB9A (0.59) NPC1RAB9AMAPTLMNABCHE
SCHEMBL3183044 0.70 MAPT (0.55) NPC1RAB9AMAPTLMNABCHE
SCHEMBL3183029 0.70 MAPT (0.55) NPC1RAB9AMAPTLMNABCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050019438-A1 Hop extracts and use thereof in the production of a medicament having estrogenic properties BOURGES-SEVENIER CEDRIC (FR) 2005-01-27 — — US claimed
EP-1381379-A1 HOP EXTRACTS AND USE THEREOF IN THE PRODUCTION OF A MEDICAMENT HAVING ESTROGENIC PROPERTIES BERKEM (FR) 2004-01-21 — — EP claimed
WO-2002085393-A1 HOP EXTRACTS AND USE THEREOF IN THE PRODUCTION OF A MEDICAMENT HAVING ESTROGENIC PROPERTIES BERKEM (FR) 2002-10-31 — — WO claimed
US-20050019438-A1 Hop extracts and use thereof in the production of a medicament having estrogenic properties BOURGES-SEVENIER CEDRIC (FR) 2005-01-27 — — US disclosed
EP-1381379-A1 HOP EXTRACTS AND USE THEREOF IN THE PRODUCTION OF A MEDICAMENT HAVING ESTROGENIC PROPERTIES BERKEM (FR) 2004-01-21 — — EP disclosed
WO-2002085393-A1 HOP EXTRACTS AND USE THEREOF IN THE PRODUCTION OF A MEDICAMENT HAVING ESTROGENIC PROPERTIES BERKEM (FR) 2002-10-31 — — WO disclosed
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