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SCHEMBL3108617

SCHEMBL3108617

COC(=O)CNC(=O)c1ccc(C2=NOC(c3cc(Cl)cc(Cl)c3)(C(F)(F)F)C2)c2ccccc12

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ FAP Q12884 2/20 0.35
▸ EGLN1 Q9GZT9 3/20 0.34
▸ VEGFA P15692 2/20 0.34
▸ FLT1 P17948 2/20 0.34
▸ EGLN3 Q9H6Z9 2/20 0.34
▸ GLA P06280 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ PDK2 Q15119 3/20 0.33
▸ MAPT P10636 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ MCL1 Q07820 1/20 0.31
▸ POLB P06746 1/20 0.31

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
SCHEMBL30394959 0.92 MEN1 (0.35) MEN1KMT2AFAPEGLN1VEGFA
SCHEMBL21253143 0.92 MEN1 (0.35) MEN1KMT2AFAPEGLN1VEGFA
SCHEMBL3102889 0.91 EGLN1 (0.34) EGLN1EGLN3
SCHEMBL1035116 0.91 ALDH1A1 (0.39) MEN1KMT2AALDH1A1MAPT
SCHEMBL1036065 0.90 PDK2 (0.36) PDK2MAPT
SCHEMBL3110029 0.90 KDM4E (0.37) MEN1KMT2AFAPALDH1A1MAPT
SCHEMBL871259 0.90 CYP1A2 (0.34) MEN1KMT2AFAPALDH1A1PDK2
SCHEMBL871261 0.90 CYP1A2 (0.34) MEN1KMT2AFAPALDH1A1PDK2
SCHEMBL871260 0.90 CYP1A2 (0.34) MEN1KMT2AFAPALDH1A1PDK2
SCHEMBL3113907 0.90 PDK2 (0.32) MEN1KMT2AFAPPDK2

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
EP-3222618-B1 NAPTHALENE ISOXAZOLINE INVERTEBRATE PEST CONTROL AGENTS DU PONT (US) 2020-09-09 — — EP disclosed
EP-3222618-A1 NAPTHALENE ISOXAZOLINE INVERTEBRATE PEST CONTROL AGENTS E. I. du Pont de Nemours and Company (US) 2017-09-27 — — EP disclosed
EP-2158188-B1 NAPHTHALENE ISOXAZOLINE INVERTEBRATE PEST CONTROL AGENTS DU PONT (US) 2017-04-26 — — EP disclosed
US-9095138-B2 Isoxazoline insecticides E.I. DU PONT DE NEMOURS AND COMPANY (US) 2015-08-04 — — US disclosed
US-9023836-B2 Use of substituted heterocyclic compounds to control sea lice on fish NOVARTIS TIERGESUNDHEIT AG (CH) 2015-05-05 — — US disclosed
US-9023836-B2 Use of substituted heterocyclic compounds to control sea lice on fish NOVARTIS TIERGESUNDHEIT AG (CH) 2015-05-05 — — US disclosed
US-20150098928-A9 ISOXAZOLINE INSECTICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2015-04-09 — — US disclosed
US-20140127165-A1 ISOXAZOLINE INSECTICIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 2014-05-08 — — US disclosed
US-20140113943-A9 Naphthalene Isoxazoline Invertebrate Pest Control Agents E.I. DU PONT DE NEMOURS AND COMPANY 2014-04-24 — — US disclosed
US-8623875-B2 Isoxazoline insecticides E.I. DU PONT DE NEMOURS AND COMPANY (US) 2014-01-07 — — US disclosed
EP-2155701-B1 ISOXAZOLINE INSECTICIDES DU PONT (US) 2013-12-11 — — EP disclosed
US-20130217736-A1 Naphthalene Isoxazoline Invertebrate Pest Control Agents DU PONT (US) 2013-08-22 — — US disclosed
US-20130095126-A1 USE OF SUBSTITUTED HETEROCYCLIC COMPOUNDS TO CONTROL SEA LICE ON FISH NOVARTIS TIERGESUNDHEIT AG (CH) 2013-04-18 — — US disclosed
US-20130095126-A1 USE OF SUBSTITUTED HETEROCYCLIC COMPOUNDS TO CONTROL SEA LICE ON FISH NOVARTIS TIERGESUNDHEIT AG (CH) 2013-04-18 — — US disclosed
US-8410153-B2 Naphthalene isoxazoline invertebrate pest control agents E.I. DU PONT DE NEMOURS AND COMPANY (US) 2013-04-02 — — US disclosed
US-20100254959-A1 NAPHTHALENE ISOXAZOLINE INVERTEBRATE PEST CONTROL AGENTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-10-07 — — US disclosed
US-20100179195-A1 ISOXAZOLINE INSECTICIDES E.I. DUPONT DE NEMOURS AND COMPANY (US) 2010-07-15 — — US disclosed
EP-2158188-A2 NAPHTHALENE ISOXAZOLINE INVERTEBRATE PEST CONTROL AGENTS E. I. Du Pont de Nemours and Company (US) 2010-03-03 — — EP disclosed
WO-2009002809-A2 NAPHTHALENE ISOXAZOLINE INVERTEBRATE PEST CONTROL AGENTS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2008-12-31 — — 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 (7 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-20100254959-A1 NAPHTHALENE ISOXAZOLINE INVERTEBRATE PEST CONTROL AGENTS C1S, C1R, C9 MEN1 2671/4885KMT2A 3444/4885FAP 3882/4885
US-20130217736-A1 Naphthalene Isoxazoline Invertebrate Pest Control Agents C1S, C1R, C9 MEN1 2671/4885KMT2A 3444/4885FAP 3882/4885
US-20140113943-A9 Naphthalene Isoxazoline Invertebrate Pest Control Agents C1S, C1R, C9 MEN1 2671/4885KMT2A 3444/4885FAP 3882/4885
US-20130095126-A1 USE OF SUBSTITUTED HETEROCYCLIC COMPOUNDS TO CONTROL SEA LICE ON FISH TYR, NISCH, GYPA MEN1 3833/4885KMT2A 477/4885FAP 2785/4885
US-20150098928-A9 ISOXAZOLINE INSECTICIDES CBR3, CYP4X1, PRDX1 MEN1 3810/4885KMT2A 3096/4885FAP 4722/4885
US-20140127165-A1 ISOXAZOLINE INSECTICIDES CBR3, CYP4X1, PRDX1 MEN1 3810/4885KMT2A 3096/4885FAP 4722/4885
US-20100179195-A1 ISOXAZOLINE INSECTICIDES CBR3, CYP4X1, PRDX1 MEN1 3810/4885KMT2A 3096/4885FAP 4722/4885

“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.