SCHEMBL3113552

SCHEMBL3113552

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

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR139 Q6DWJ6 6/20 0.35
POLB P06746 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PSMB5 P28074 5/20 0.33
PSMB1 P20618 4/20 0.33
PSMB2 P49721 4/20 0.33
PSMB11 A5LHX3 3/20 0.33
PSMA7 O14818 3/20 0.33
PSMA1 P25786 3/20 0.33
PSMA2 P25787 3/20 0.33
PSMA3 P25788 3/20 0.33
PSMA4 P25789 3/20 0.33
PSMB8 P28062 3/20 0.33
PSMB9 P28065 3/20 0.33
PSMA5 P28066 3/20 0.33
PSMB4 P28070 3/20 0.33
PSMB6 P28072 3/20 0.33

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
SCHEMBL3104839 0.91 GPR139 (0.38) GPR139MEN1KMT2APSMB5PSMB1
SCHEMBL3113907 0.91 PDK2 (0.32) GPR139MEN1KMT2ATDP1FAP
SCHEMBL3108150 0.90 PDK2 (0.34) GPR139POLBMEN1KMT2ATDP1
SCHEMBL3113195 0.90 PTGES (0.32) POLBMEN1KMT2ASMN1; SMN2TDP1
SCHEMBL119082 0.90 PTGES (0.32) POLBMEN1KMT2ASMN1; SMN2TDP1
SCHEMBL20117288 0.90 PTGES (0.32) POLBMEN1KMT2ASMN1; SMN2TDP1
SCHEMBL29416682 0.90 PTGES (0.32) POLBMEN1KMT2ASMN1; SMN2TDP1
SCHEMBL3111715 0.89 FAP (0.38) GPR139PSMB5PSMB8FAP
SCHEMBL3118543 0.89 MEN1 (0.33) MEN1KMT2ATDP1
SCHEMBL3104838 0.89 MEN1 (0.33) MEN1KMT2ATDP1

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 8 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
US-20140113943-A9 Naphthalene Isoxazoline Invertebrate Pest Control Agents E.I. DU PONT DE NEMOURS AND COMPANY 2014-04-24 US disclosed
US-20130217736-A1 Naphthalene Isoxazoline Invertebrate Pest Control Agents DU PONT (US) 2013-08-22 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
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 (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-20100254959-A1 NAPHTHALENE ISOXAZOLINE INVERTEBRATE PEST CONTROL AGENTS C1S, C1R, C9 GPR139 1150/4885POLB 4443/4885MEN1 2671/4885
US-20130217736-A1 Naphthalene Isoxazoline Invertebrate Pest Control Agents C1S, C1R, C9 GPR139 1150/4885POLB 4443/4885MEN1 2671/4885
US-20140113943-A9 Naphthalene Isoxazoline Invertebrate Pest Control Agents C1S, C1R, C9 GPR139 1150/4885POLB 4443/4885MEN1 2671/4885

“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.