SCHEMBL19554754

SCHEMBL19554754

CC(Br)c1ncnn1-c1ccccn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ MAPT P10636 3/20 0.35
▸ IRAK4 Q9NWZ3 1/20 0.35
▸ NPC1 O15118 2/20 0.34
▸ CYP17A1 P05093 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ THRB P10828 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ FFAR4 Q5NUL3 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ PLD1 Q13393 1/20 0.33
▸ CCNA2 P20248 1/20 0.33
▸ CDK2 P24941 1/20 0.33
▸ PANK3 Q9H999 1/20 0.33
▸ ALOX15 P16050 1/20 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
SCHEMBL30160609 1.00 RAB9A (0.38) RAB9ASMN1; SMN2MAPTIRAK4NPC1
SCHEMBL20337257 0.84 IRAK4 (0.43) RAB9ASMN1; SMN2MAPTIRAK4NPC1
SCHEMBL19554783 0.80 — —
SCHEMBL20337284 0.76 CTSK (0.36) RAB9ASMN1; SMN2MAPTNPC1ALDH1A1
SCHEMBL20337115 0.76 SIGMAR1 (0.38) SMN1; SMN2MAPTALDH1A1THRBTDP1
SCHEMBL23329611 0.75 CNR1 (0.34) —
SCHEMBL30160326 0.75 CNR1 (0.34) —
SCHEMBL20337120 0.75 GFER (0.32) RAB9ASMN1; SMN2MAPTIRAK4NPC1
SCHEMBL20337156 0.75 CYP1A2 (0.35) RAB9ASMN1; SMN2MAPTIRAK4NPC1
SCHEMBL20337124 0.75 PIK3CD (0.35) RAB9ASMN1; SMN2IRAK4NPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230131903-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-04-27 — — US disclosed
US-20230131903-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-04-27 — — US disclosed
US-20230131903-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-04-27 — — US disclosed
US-20230002359-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-01-05 — — US disclosed
US-20230002359-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-01-05 — — US disclosed
WO-2021083936-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2021-05-06 — — WO disclosed
CN-109311841-B Heteroaryl-1, 2, 4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites 瑞士伊兰科动物保健有限公司 2021-04-27 — — CN disclosed
US-10981897-B2 Heteroaryl-1,2,4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites ELANCO TIERGESUNDHEIT AG (US) 2021-04-20 — — US disclosed
US-10981897-B2 Heteroaryl-1,2,4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites ELANCO TIERGESUNDHEIT AG (US) 2021-04-20 — — US disclosed
EP-3452460-B1 HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES ELANCO TIERGESUNDHEIT AG (CH) 2020-02-12 — — EP disclosed
US-20190256501-A1 HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES ELANCO TIERGESUNDHEIT AG (US) 2019-08-22 — — US disclosed
US-20190256501-A1 HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES ELANCO TIERGESUNDHEIT AG (US) 2019-08-22 — — US disclosed
US-10287276-B2 Heteroaryl-1,2,4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites ELANCO TIERGESUNDHEIT AG (CH) 2019-05-14 — — US disclosed
US-10287276-B2 Heteroaryl-1,2,4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites ELANCO TIERGESUNDHEIT AG (CH) 2019-05-14 — — US disclosed
EP-3452460-A1 HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES Elanco Tiergesundheit AG (CH) 2019-03-13 — — EP disclosed
CN-109311841-A Heteroaryl-1, 2, 4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites 瑞士伊兰科动物保健有限公司 2019-02-05 — — CN disclosed
US-20180186778-A1 HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES ELANCO TIERGESUNDHEIT AG (CH) 2018-07-05 — — US disclosed
US-20180186778-A1 HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES ELANCO TIERGESUNDHEIT AG (CH) 2018-07-05 — — US disclosed
US-20180186778-A1 HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES ELANCO TIERGESUNDHEIT AG (CH) 2018-07-05 — — US disclosed
WO-2017192385-A1 HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES ELANCO TIERGESUNDHEIT AG (CH) 2017-11-09 — — 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 (6 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-10981897-B2 Heteroaryl-1,2,4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites CBR3, HRH4, H1-5 RAB9A 2562/4885SMN1; SMN2 4745/4885MAPT 4783/4885
US-20230131903-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS DDT, ACHE, GSTO1 RAB9A 1157/4885SMN1; SMN2 875/4885MAPT 194/4885
US-10287276-B2 Heteroaryl-1,2,4-triazole and heteroaryl-tetrazole compounds for controlling ectoparasites CBR3, HRH4, H1-5 RAB9A 2562/4885SMN1; SMN2 4745/4885MAPT 4783/4885
US-20190256501-A1 HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES CBR3, HRH4, H1-5 RAB9A 2562/4885SMN1; SMN2 4745/4885MAPT 4783/4885
US-20180186778-A1 HETEROARYL-1,2,4-TRIAZOLE AND HETEROARYL-TETRAZOLE COMPOUNDS FOR CONTROLLING ECTOPARASITES CBR3, HRH4, H1-5 RAB9A 2562/4885SMN1; SMN2 4745/4885MAPT 4783/4885
US-20230002359-A1 PESTICIDALLY ACTIVE FUSED BICYCLIC HETEROAROMATIC COMPOUNDS DDT, ACHE, GSTO1 RAB9A 1020/4885SMN1; SMN2 960/4885MAPT 283/4885

“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.

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