SCHEMBL2292879

SCHEMBL2292879

CC(C)(C)c1cc(Cc2nc(Cc3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)nc(Cc3cc(C(C)(C)C)c(O)c(C(C)(C)C)c3)n2)cc(C(C)(C)C)c1O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.54
ALDH1A1 P00352 8/20 0.53
TSHR P16473 3/20 0.53
LMNA P02545 2/20 0.53
GAA P10253 1/20 0.53
MAPK1 P28482 3/20 0.52
MEN1 O00255 2/20 0.52
CYP1A2 P05177 2/20 0.52
CYP3A4 P08684 2/20 0.52
BLM P54132 2/20 0.52
KMT2A Q03164 2/20 0.52
ATM Q13315 2/20 0.52
HIF1A Q16665 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
ALOX15 P16050 2/20 0.52
GMNN O75496 1/20 0.52
GABBR2 O75899 1/20 0.52
TP53 P04637 1/20 0.52
CYP2C9 P11712 1/20 0.52
NFKB1 P19838 1/20 0.52

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
SCHEMBL39559 0.85 ALDH1A1 (0.63) DHFRALDH1A1TSHRLMNAGAA
SCHEMBL23197324 0.85 DHFR (0.46) DHFRALDH1A1TSHRLMNAGAA
SCHEMBL11430262 0.83 DHFR (0.50) DHFRALDH1A1TSHRLMNAGAA
SCHEMBL526641 0.83 ALDH1A1 (0.61) DHFRALDH1A1TSHRLMNAGAA
SCHEMBL39496 0.82 ALDH1A1 (0.52) DHFRALDH1A1TSHRLMNAGAA
SCHEMBL11083568 0.82 DHFR (0.49) DHFRALDH1A1TSHRLMNAGAA
Benzene SCHEMBL9807217 0.81 ALDH1A1 (0.59) DHFRALDH1A1TSHRLMNAGAA
SCHEMBL698207 0.79 GAA (0.49) DHFRALDH1A1TSHRLMNAGAA
Methylamine SCHEMBL27974836 0.79 ALDH1A1 (0.57) DHFRALDH1A1TSHRLMNAGAA
SCHEMBL9338699 0.79 ALDH1A1 (0.57) DHFRALDH1A1TSHRLMNAGAA

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2512397-A1 PLASTIC PRESSURE VESSEL FOR BIOPHARMACEUTICAL APPLICATIONS AND METHODS THEREOF 3M Innovative Properties Company (US) 2012-10-24 EP disclosed
US-20120252118-A1 PLASTIC PRESSURE VESSEL FOR BIOPHARMACEUTICAL APPLICATIONS AND METHODS THEREOF 3M INNOVATIVE PROPERTIES COMPANY 2012-10-04 US disclosed
WO-2011084176-A1 PLASTIC PRESSURE VESSEL FOR BIOPHARMACEUTICAL APPLICATIONS AND METHODS THEREOF 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-07-14 WO disclosed
EP-1405879-A1 FLAME RETARDANT POLYETHYLENE TEREPHTHALATE RESIN COMPOSITION Win Tech Polymer Ltd. (JP) 2004-04-07 EP disclosed
US-4923909-A THIXOTROPIC SLURRYING; PIPES; STABILITY; THERMOPLASTIC OR THERMOSETTING RESIN; LIQUID CARRIER THE B. F. GOODRICH COMPANY (US) 1990-05-08 US disclosed
EP-0099231-B1 POLYPHENYLENE ETHER RESIN COMPOSITION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1987-11-25 EP disclosed
EP-0099230-B1 POLYPHENYLENE ETHER RESIN COMPOSITION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1987-04-22 EP disclosed
EP-0038183-B1 POLYPHENYLENE ETHER RESIN COMPOSITIONS AND SHAPED ARTICLES THEREOF MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1985-07-31 EP disclosed
US-4500662-A STABILIZERS OF POLYMERIC MATERIALS AGAINST ULTRAVIOLET DEGRADATION THE B. F. GOODRICH COMPANY (US) 1985-02-19 US disclosed
US-4495320-A 3,6-Di-t-butyl-2-naphthyl catechol phosphite and compositions thereof THE B. F. GOODRICH COMPANY (US) 1985-01-22 US disclosed
US-4326061-A ULTRAVIOLET RADIATION, STABILIZERS THE B. F. GOODRICH COMPANY (US) 1982-04-20 US disclosed
EP-0038183-A1 Polyphenylene ether resin compositions and shaped articles thereof MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1981-10-21 EP disclosed
EP-0036278-A1 Polyphenylene ether resin composition of improved heat stability and shaped articles thereof MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1981-09-23 EP disclosed
US-4251435-A FOR POLYOLEFINS THE B. F. GOODRICH COMPANY (US) 1981-02-17 US disclosed
US-4190571-A POLYOLEFINS THE B. F. GOODRICH COMPANY (US) 1980-02-26 US disclosed
US-4184999-A RUBBER-MODIFIED VINYLAROMATIC RESIN GENERAL ELECTRIC COMPANY (US) 1980-01-22 US disclosed
US-4154719-A ALKENYL AROMATIC RESIN MODIFIED WITH A DIENE RUBBER GENERAL ELECTRIC COMPANY (US) 1979-05-15 US disclosed
US-4073770-A Substituted decahydroquinolines and their use as ultraviolet light stabilizers THE B. F. GOODRICH COMPANY (US) 1978-02-14 US disclosed
US-4069195-A FOR POLYOLEFINS THE B.F. GOODRICH COMPANY (US) 1978-01-17 US disclosed
US-3957721-A Stabilizer combinations of (β-aminoacrlyl compounds and phenolic compounds and stabilized compositions thereof THE B. F. GOODRICH COMPANY (US) 1976-05-18 US disclosed