SCHEMBL5380153

SCHEMBL5380153

Oc1ccc(-c2cccc3c2oc2ccccc23)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.69
CDC14B O60729 1/20 0.51
CDC14A Q9UNH5 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
CYP3A4 P08684 1/20 0.47
ALOX15 P16050 1/20 0.47
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
HSD17B10 Q99714 1/20 0.47
FTO Q9C0B1 1/20 0.47
KDM4E B2RXH2 1/20 0.47
TNKS O95271 1/20 0.47
BCHE P06276 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL12037130 0.91 ALOX5 (0.59) ALOX5CDC14BCDC14ASMN1; SMN2ALDH1A1
SCHEMBL16582801 0.91 ALOX5 (0.70) ALOX5CDC14BCDC14ASMN1; SMN2ALDH1A1
SCHEMBL12037217 0.90 ALOX5 (0.58) ALOX5CDC14BCDC14ASMN1; SMN2ALDH1A1
SCHEMBL3865828 0.89 ALOX5 (0.69) ALOX5CDC14BCDC14ASMN1; SMN2ALDH1A1
SCHEMBL24171048 0.89 ALOX5 (0.68) ALOX5CDC14BCDC14ASMN1; SMN2ALDH1A1
SCHEMBL431876 0.87 ALOX5 (0.66) ALOX5CDC14BCDC14ASMN1; SMN2ALDH1A1
SCHEMBL18698053 0.86 ALOX5 (0.64) ALOX5CDC14BCDC14ASMN1; SMN2ALDH1A1
SCHEMBL12324537 0.86 ALOX5 (0.64) ALOX5CDC14BCDC14ASMN1; SMN2ALDH1A1
SCHEMBL30257190 0.86 ALOX5 (0.64) ALOX5CDC14BCDC14ASMN1; SMN2ALDH1A1
SCHEMBL11712766 0.85 ALOX5 (0.63) ALOX5CDC14BCDC14ASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170298077-A1 HETEROCYCLIC COMPOUNDS WITH BENZO(C)COUMARIN-STRUCTURES MERCK PATENT GMBH (DE) 2017-10-19 US disclosed
US-9735373-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2017-08-15 US disclosed
US-9735373-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2017-08-15 US disclosed
US-9735373-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2017-08-15 US disclosed
US-20140361252-A1 ALUMINUM CHELATES AS MATERIALS FOR OLEDS UNIVERSAL DISPLAY CORPORATION (US) 2014-12-11 US disclosed
US-20140361252-A1 ALUMINUM CHELATES AS MATERIALS FOR OLEDS UNIVERSAL DISPLAY CORPORATION (US) 2014-12-11 US disclosed
US-20140361252-A1 ALUMINUM CHELATES AS MATERIALS FOR OLEDS UNIVERSAL DISPLAY CORPORATION (US) 2014-12-11 US disclosed
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors BROOKS DAWN A 2007-11-29 US disclosed
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed
US-7192982-B2 Modulators of peroxisome proliferator activated receptors LIGAND PHARMACEUTICALS, INC. (US) 2007-03-20 US disclosed
US-20050020684-A1 Modulators of peroxisome proliferator activated receptors ELI LILLY AND COMPANY 2005-01-27 US disclosed
EP-1392637-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2004-03-03 EP disclosed
WO-2002100813-A2 MODULATORS OF PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS ELI LILLY AND COMPANY (US) 2002-12-19 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-20170298077-A1 HETEROCYCLIC COMPOUNDS WITH BENZO(C)COUMARIN-STRUCTURES NISCH, SIRT3, NQO1 ALOX5 2630/4885CDC14B 3740/4885CDC14A 3399/4885
US-20050020684-A1 Modulators of peroxisome proliferator activated receptors NCOA4, PPARG, PPARA ALOX5 1617/4885CDC14B 4356/4885CDC14A 4336/4885
US-20070276138-A1 Modulators of peroxisome proliferator activated receptors PPARG, NCOA4, PPARA ALOX5 1600/4885CDC14B 4451/4885CDC14A 4441/4885

“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.