SCHEMBL8468614

SCHEMBL8468614

CCCCCCCCCCCCCCCCCCOC(=O)CSc1cc(C)c(O)c(C)c1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.59
AKR1C4 P17516 1/20 0.47
AKR1C3 P42330 1/20 0.47
AKR1C2 P52895 1/20 0.47
AKR1C1 Q04828 1/20 0.47
NAAA Q02083 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
FAAH O00519 1/20 0.43
ATM Q13315 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL7004427 0.82 ESR1 (0.58) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL647318 0.82 ESR1 (0.58) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL9296175 0.82 ESR1 (0.58) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL11217664 0.81 ESR1 (0.49) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL9297212 0.80 ESR1 (0.55) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL18399905 0.77 THRB (0.55) ESR1SMN1; SMN2
SCHEMBL5013002 0.77 THRB (0.55) ESR1SMN1; SMN2
SCHEMBL200878 0.77 THRB (0.55) ESR1SMN1; SMN2
SCHEMBL9230453 0.76 ESR1 (0.61) ESR1AKR1C4AKR1C3AKR1C2AKR1C1
SCHEMBL9222985 0.76 ESR1 (0.61) ESR1AKR1C4AKR1C3AKR1C2AKR1C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5869184-A RESIN RAW MATERIALS FOR PAINTS, ADHESIVES MITSUI TOATSU CHEMICALS, INC. (JP) 1999-02-09 US disclosed
US-5744504-A AMINO RESIN; THERMOSETTING MOLDING MATERIALS MITSUI TOATSU CHEMICALS, INC. (JP) 1998-04-28 US disclosed
US-5648446-A ADHESIVES, FIREPROOFING, HEAT RESISTANCE IN RESINS FOR MOLDING MATERIALS MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-15 US disclosed
US-5646240-A THERMOSETTING MOLDING COMPOSITIONS MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-08 US disclosed
US-5596039-A FLAME RETARDERS, HEAT RESISTANCE MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1997-01-21 US disclosed
US-5569726-A USEFUL IN FLAME-RETARDING, THERMAL STABILIZATION AND COMPATIBILIZATION OF RESINS AND IN THERMOSETTING MOLDING COMPOSITIONS MITSUI TOATSU CHEMICALS, INC. (JP) 1996-10-29 US disclosed
US-5545702-A THERMOSETTING RESIN COMPOSITION MITSUI TOATSU CHEMICALS, INC. (JP) 1996-08-13 US disclosed
US-5536795-A ADHESIVES AND PAINTS AND FIREPROOFING THERMOSETTING RESINS MITSUI TOATSU CHEMICALS, INC. (JP) 1996-07-16 US disclosed
US-5480947-A N-METHYLOL DIGUANAMINES MITSUI TOATSU CHEMICALS, INC. (JP) 1996-01-02 US disclosed
EP-0612797-A2 Modification method of resins MITSUI TOATSU CHEMICALS, Inc. (JP) 1994-08-31 EP disclosed
US-4248976-A COMPRISING A PHOSPHORUS COMPOUND AND AN AROMATIC COMPOUND CIBA-GEIGY AG (CH) 1981-02-03 US disclosed
US-4207224-A Plastics composition CIBA-GEIGY AG (CH) 1980-06-10 US disclosed
US-4172858-A Flame-resistant polymer compositions CIBA-GEIGY AG (CH) 1979-10-30 US disclosed
US-4038250-A SUBSTITUTED P-HYDROXYBENOZIC ACID PHENYL ESTERS CIBA-GEIGY CORPORATION (US) 1977-07-26 US disclosed
US-4038247-A STABILIZING POLYOLEFINS WITH DIACYL DIHYDRAZIDES CIBA-GEIGY CORPORATION (US) 1977-07-26 US disclosed
US-4026866-A Nickel stabilizers for synthetic polymers CIBA-GEIGY CORPORATION (US) 1977-05-31 US disclosed
US-4012360-A Bis-salicyloyl-dicarboxylic acid dihydrazides as stabilizers for polyolefines CIBA-GEIGY CORPORATION (US) 1977-03-15 US disclosed
US-3993622-A Bis-salicyloyl-hydrazine as stabilizer for polymers CIBA-GEIGY CORPORATION (US) 1976-11-23 US disclosed
US-3954708-A Synthetic polymers stabilized with a nickel benzoate and a polyol CIBA-GEIGY CORPORATION (US) 1976-05-04 US disclosed