SCHEMBL2010586

SCHEMBL2010586

C=Cc1ccc(C(=O)OC)n2ccnc12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 2/20 0.34
HSP90B1 P14625 2/20 0.34
ALOX15 P16050 1/20 0.34
HTT P42858 1/20 0.34
CCNE1 P24864 1/20 0.33
CDK2 P24941 1/20 0.33
KDM4E B2RXH2 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 2/20 0.32
GRK6 P43250 1/20 0.32
JMJD6 Q6NYC1 1/20 0.32
MAPK1 P28482 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
F2 P00734 1/20 0.32
PLAU P00749 1/20 0.32
KLKB1 P03952 1/20 0.32
ELANE P08246 1/20 0.32

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
SCHEMBL2033695 0.87 ALDH1A1 (0.35) ALOX15HTTCCNE1CDK2KDM4E
SCHEMBL2033885 0.84 KDM4E (0.43) ALOX15HTTCCNE1CDK2KDM4E
SCHEMBL12630599 0.84 KDM4E (0.43) ALOX15HTTCCNE1CDK2KDM4E
SCHEMBL23029798 0.80 SSTR4 (0.42) ALOX15HTTKDM4ESMN1; SMN2ALDH1A1
SCHEMBL31055986 0.80 KDM4E (0.42) HSP90B1ALOX15HTTKDM4ESMN1; SMN2
SCHEMBL31056002 0.78 PTK2 (0.40) PTK2IRAK4MAPTKMT2AL3MBTL1
SCHEMBL17590179 0.78 F2 (0.37) HTTKDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL2030923 0.78 GAA (0.36) HTTKDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL24857365 0.76 SSTR4 (0.40) HTTKDM4ESMN1; SMN2ALDH1A1HPGD
SCHEMBL24857582 0.76 KDR (0.35) KDM4ESMN1; SMN2ALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3560923-B1 ANTI PARASITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME BOEHRINGER INGELHEIM ANIMAL HEALTH USA INC (US) 2021-05-05 EP disclosed
EP-3560923-B1 ANTI PARASITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME BOEHRINGER INGELHEIM ANIMAL HEALTH USA INC (US) 2021-05-05 EP disclosed
EP-3560923-A1 ANTI PARASITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME Boehringer Ingelheim Animal Health USA Inc. (US) 2019-10-30 EP disclosed
EP-3560923-A1 ANTI PARASITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME Boehringer Ingelheim Animal Health USA Inc. (US) 2019-10-30 EP disclosed
EP-3078664-B1 ANTIPARASITIC DIHYDROAZOLE COMPOSITIONS MERIAL INC (US) 2019-02-20 EP disclosed
US-9776999-B2 Antiparisitic dihydroazole compounds and compositions comprising same MERIAL INC. (US) 2017-10-03 US disclosed
US-9776999-B2 Antiparisitic dihydroazole compounds and compositions comprising same MERIAL INC. (US) 2017-10-03 US disclosed
US-9776999-B2 Antiparisitic dihydroazole compounds and compositions comprising same MERIAL INC. (US) 2017-10-03 US disclosed
US-20170022197-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL, INC. (US) 2017-01-26 US disclosed
US-20170022197-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL, INC. (US) 2017-01-26 US disclosed
US-20140315794-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL LIMITED (US) 2014-10-23 US disclosed
US-20140315794-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL LIMITED (US) 2014-10-23 US disclosed
US-20140315794-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL LIMITED (US) 2014-10-23 US disclosed
US-8618126-B2 Antiparisitic dihydroazole compounds and compositions comprising same MERIAL LIMITED (US) 2013-12-31 US disclosed
EP-2513104-A1 ANTI PARASITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME Merial Limited (US) 2012-10-24 EP disclosed
WO-2011075591-A1 ANTI PARASITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL LIMITED (US) 2011-06-23 WO disclosed
WO-2011075591-A1 ANTI PARASITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL LIMITED (US) 2011-06-23 WO disclosed
US-20110152312-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL, INC. 2011-06-23 US disclosed
US-20110152312-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL, INC. 2011-06-23 US disclosed
US-20110152312-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME MERIAL, INC. 2011-06-23 US 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-20140315794-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME DDT, CYP1A1, CYP1A2 HSP90AA1 1269/4885HSP90B1 1587/4885ALOX15 1550/4885
US-20110152312-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME DDT, CYP1A1, CYP1A2 HSP90AA1 1269/4885HSP90B1 1587/4885ALOX15 1550/4885
US-20170022197-A1 ANTIPARISITIC DIHYDROAZOLE COMPOUNDS AND COMPOSITIONS COMPRISING SAME DDT, CYP1A1, CYP1A2 HSP90AA1 1269/4885HSP90B1 1587/4885ALOX15 1550/4885

“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.