SCHEMBL1822386

SCHEMBL1822386

CC(Cc1cc(-c2ccccc2)c(-c2ccccc2)s1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.44
NR4A2 P43354 1/20 0.44
SLC22A12 Q96S37 2/20 0.42
KMT2A Q03164 3/20 0.41
PLA2G10 O15496 3/20 0.40
PLA2G2A P14555 3/20 0.40
PTGER1 P34995 1/20 0.40
PTGER4 P35408 1/20 0.40
PTGER3 P43115 1/20 0.40
PTGER2 P43116 1/20 0.40
PLA2G1B P04054 1/20 0.40
PLA2G5 P39877 1/20 0.40
PLA2G2C Q5R387 1/20 0.40
PLA2G12B Q9BX93 1/20 0.40
PLA2G12A Q9BZM1 1/20 0.40
PLA2G2F Q9BZM2 1/20 0.40
PLA2G3 Q9NZ20 1/20 0.40
PLA2G2E Q9NZK7 1/20 0.40
PLA2G2D Q9UNK4 1/20 0.40
PTGS1 P23219 3/20 0.38

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
SCHEMBL1824805 0.85 RXRA (0.44) RXRANR4A2SLC22A12KMT2APLA2G10
SCHEMBL1826483 0.85 HPGD (0.48) RXRANR4A2SLC22A12PLA2G10PLA2G2A
SCHEMBL6570187 0.77 PPARG (0.39) RXRANR4A2SLC22A12KMT2APTGS1
SCHEMBL1823601 0.74 FFAR1 (0.46) RXRANR4A2SLC22A12PTGER1PTGER4
SCHEMBL23189270 0.71 KMT2A (0.71) RXRANR4A2KMT2APTGER1PTGER4
SCHEMBL3149585 0.71 KMT2A (0.71) RXRANR4A2KMT2APTGER1PTGER4
SCHEMBL2841456 0.71 CYP2A6 (0.48) CYP1A2CYP2C9CYP2C19HSD17B1
SCHEMBL7899711 0.70 OPRD1 (0.51) PTGS2MAPTHPGDCYP2C19KDM4E
SCHEMBL1826614 0.70 MAPK14 (0.36) RXRANR4A2SLC22A12MAPTAKR1C3
SCHEMBL3157543 0.68 PTGER1 (0.48) RXRANR4A2KMT2APLA2G10PLA2G2A

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
EP-1854804-B1 Heterocyclic metallocene compounds and use thereof in catalyst systems for producing olefin polymers BASELL POLYOLEFINE GMBH (DE) 2011-05-04 EP disclosed
EP-1854804-A1 Heterocyclic metallocene compounds and use thereof in catalyst systems for producing olefin polymers Basell Polyolefine GmbH (DE) 2007-11-14 EP disclosed
US-7112638-B2 Hetero cyclic metallocene compounds and use thereof in catalyst system for producing olefin polymers BASELL POLYOLEFINE GMBH (DE) 2006-09-26 US disclosed
US-20030036612-A1 Hetero cyclic metallocene compounds and use thereof in catalyst system for producing olefin polymers BASELL POLYOLEFINE GMBH (DE) 2003-02-20 US disclosed
EP-1157027-A1 HETEROCYCLIC METALLOCENE COMPOUNDS AND USE THEREOF IN CATALYST SYSTEMS FOR PRODUCING OLEFIN POLYMERS Basell Technology Company B.V. (NL) 2001-11-28 EP disclosed
WO-2001047939-A1 HETEROCYCLIC METALLOCENE COMPOUNDS AND USE THEREOF IN CATALYST SYSTEMS FOR PRODUCING OLEFIN POLYMERS BASELL TECHNOLOGY COMPANY B.V. (NL) 2001-07-05 WO disclosed