SCHEMBL1334895

SCHEMBL1334895

CCC(C)OP(=O)(O)Cc1ccc(Br)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 4/20 0.38
KMT2A Q03164 2/20 0.36
PGK1 P00558 1/20 0.36
PGK2 P07205 1/20 0.36
EPHX1 P07099 2/20 0.36
POLB P06746 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
RAB9A P51151 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ENPP2 Q13822 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL915243 0.86 PGK1 (0.37) KMT2APGK1PGK2RAB9ASMN1; SMN2
SCHEMBL915165 0.86 ESR1 (0.38) KMT2APGK1PGK2MEN1LMNA
SCHEMBL4633893 0.84 TRPA1 (0.40) PGK1PGK2ALDH1A1LMNAENPP2
SCHEMBL915104 0.84 FDPS (0.40) PGK1PGK2RAB9AALDH1A1SMN1; SMN2
SCHEMBL917066 0.84 HTT (0.37) KMT2APGK1PGK2POLBCTDSP1
SCHEMBL1760139 0.84 PGK1 (0.36) PGK1PGK2SMN1; SMN2CYP3A4CYP2C19
SCHEMBL1407856 0.84 TRPA1 (0.42) KMT2APOLBMEN1
SCHEMBL914038 0.83 ANPEP (0.44) RAB9AALDH1A1SMN1; SMN2CYP2C19
SCHEMBL1307263 0.82 PGK1 (0.38) PGK1PGK2POLBALDH1A1LMNA
SCHEMBL1575114 0.82 SLC6A4 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109705041-B Triphenylamine substituted-vinyl modified phenanthroimidazole compound, preparation method thereof and application thereof as electroluminescent device 广东工业大学 2022-06-14 CN disclosed
EP-1398340-B1 BLOCK COPOLYMER AND POLYMERIC LUMINESCENT ELEMENT SUMITOMO CHEMICAL CO (JP) 2017-11-08 EP disclosed
EP-2499121-B1 OXAZOLINE DERIVATIVES FOR TREATMENT OF CNS DISORDERS. HOFFMANN LA ROCHE (CH) 2015-10-07 EP disclosed
EP-2635560-B1 DIHYDROOXAZOL-2-AMINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2015-09-30 EP disclosed
EP-2333006-B1 Block copolymer and polymeric luminescent element SUMITOMO CHEMICAL CO (JP) 2014-10-29 EP disclosed
US-8673950-B2 Dihydrooxazol-2-amine derivatives HOFFMANN-LAROCHE INC. (US) 2014-03-18 US disclosed
US-20130345241-A1 DIHYDROOXAZOL-2-AMINE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2013-12-26 US disclosed
EP-2635560-A1 DIHYDROOXAZOL-2-AMINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2013-09-11 EP disclosed
US-8367869-B2 Aromatic amine derivative and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2013-02-05 US disclosed
US-8354441-B2 Oxazoline derivatives HOFFMANN-LA ROCHE INC. (US) 2013-01-15 US disclosed
US-7125930-B2 Block copolymer and polymeric luminescent element SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-10-24 US disclosed
EP-1408985-A4 NOVEL PYRIDOPYRIMIDONES AND USES THEREOF ARIAD PHARMA INC (US) 2006-03-22 EP disclosed
US-20040100804-A1 Solid pahse fluorescence; low molecular weight light emission diodes SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-05-27 US disclosed
EP-1408985-A1 NOVEL PYRIDOPYRIMIDONES AND USES THEREOF ARIAD PHARMACEUTICALS, INC. (US) 2004-04-21 EP disclosed
EP-1398340-A1 BLOCK COPOLYMER AND POLYMERIC LUMINESCENT ELEMENT Sumitomo Chemical Company, Limited (JP) 2004-03-17 EP disclosed
US-20030100572-A1 Novel pyridopyrimidones and uses thereof ARIAD PHARMACEUTICALS,INC. 2003-05-29 US disclosed
WO-2003000270-A1 NOVEL PYRIDOPYRIMIDONES AND USES THEREOF ARIAD PHARMACEUTICALS, INC. (US) 2003-01-03 WO disclosed
EP-1246829-A1 NOVEL HETEROCYCLES ARIAD PHARMACEUTICALS, INC. (US) 2002-10-09 EP disclosed
US-20020103161-A1 Novel heterocycles ARIAD PHARMACEUTICALS, INC. 2002-08-01 US disclosed
WO-2001044258-A1 NOVEL HETEROCYCLES ARIAD PHARMACEUTICALS, INC. (US) 2001-06-21 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030100572-A1 Novel pyridopyrimidones and uses thereof UQCRB, RRM2B, CYP2B6 FPR2 927/4885KMT2A 3838/4885PGK1 1321/4885
US-20020103161-A1 Novel heterocycles BMP2, SOST, BMP4 FPR2 996/4885KMT2A 3040/4885PGK1 1544/4885
US-20130345241-A1 DIHYDROOXAZOL-2-AMINE DERIVATIVES TAAR1, TAAR5, HCRTR1 FPR2 2493/4885KMT2A 1958/4885PGK1 1642/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.