SCHEMBL98132

SCHEMBL98132

CCCCCCCCOc1cc(-c2ccccc2)c(O)c(-c2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SOAT1 P35610 1/20 0.52
▸ NR5A1 Q13285 1/20 0.51
▸ HDAC8 Q9BY41 2/20 0.51
▸ PTPN11 Q06124 3/20 0.50
▸ PLA2G2A P14555 1/20 0.50
▸ PTPN1 P18031 1/20 0.50
▸ LTA4H P09960 1/20 0.50
▸ MLNR O43193 1/20 0.48
▸ NR1I2 O75469 1/20 0.48
▸ ESR1 P03372 1/20 0.48
▸ NR3C1 P04150 1/20 0.48
▸ PGR P06401 1/20 0.48
▸ ADRB2 P07550 1/20 0.48
▸ CHRM2 P08172 1/20 0.48
▸ ADRB1 P08588 1/20 0.48
▸ HTR1A P08908 1/20 0.48
▸ ADRA2A P08913 1/20 0.48
▸ ADORA3 P0DMS8 1/20 0.48
▸ CHRM1 P11229 1/20 0.48
▸ DRD2 P14416 1/20 0.48

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
SCHEMBL39560 1.00 SOAT1 (0.52) SOAT1NR5A1HDAC8PTPN11PLA2G2A
SCHEMBL5991642 1.00 SOAT1 (0.52) SOAT1NR5A1HDAC8PTPN11PLA2G2A
SCHEMBL5988283 0.94 BACE1 (0.53) SOAT1NR5A1HDAC8PTPN11PTPN1
SCHEMBL6866588 0.85 HDAC8 (0.55) SOAT1NR5A1HDAC8PTPN11PTPN1
E319 SCHEMBL2009146 0.84 ALDH1A1 (0.44) SOAT1NR5A1HDAC8PTPN1NR1I2
SCHEMBL11572105 0.84 SOAT1 (0.53) SOAT1NR5A1HDAC8PTPN11PTPN1
SCHEMBL11535392 0.84 SOAT1 (0.53) SOAT1NR5A1HDAC8PTPN11PTPN1
SCHEMBL7941538 0.83 PTPN11 (0.59) SOAT1NR5A1HDAC8PTPN11PTPN1
SCHEMBL17388694 0.83 PTPN11 (0.59) SOAT1NR5A1HDAC8PTPN11PTPN1
SCHEMBL5057429 0.83 PTPN1 (0.61) SOAT1NR5A1HDAC8PTPN11PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120108732-A1 DISPERSION LIQUID OF CHEMICAL FOR RUBBERS, METHOD FOR PRODUCING SAME, RUBBER WET MASTER BATCH CONTAINING CHEMICAL FOR RUBBERS, RUBBER COMPOSITION, AND TIRE BRIDGESTONE CORPORATION (JP) 2012-05-03 — — US disclosed
EP-2426170-A1 DISPERSION LIQUID OF CHEMICAL FOR RUBBERS, METHOD FOR PRODUCING SAME, RUBBER WET MASTER BATCH CONTAINING CHEMICAL FOR RUBBERS, RUBBER COMPOSITION, AND TIRE Bridgestone Corporation (JP) 2012-03-07 — — EP disclosed
US-20080139734-A1 Sealing Material Composition KANEKA CORPORATION (JP) 2008-06-12 — — US disclosed
EP-1743928-A1 SEALING MATERIAL COMPOSITION KANEKA CORPORATION (JP) 2007-01-17 — — EP disclosed
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