SCHEMBL20636715

SCHEMBL20636715

Cn1c(N)nc2cc(C(F)(F)F)cnc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NTRK1 P04629 4/20 0.35
CSF1R P07333 4/20 0.35
NTRK2 Q16620 4/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2C19 P33261 2/20 0.34
CACNA1D Q01668 1/20 0.34
MET P08581 1/20 0.34
MAOB P27338 1/20 0.34
CYP3A4 P08684 1/20 0.34
RAB9A P51151 1/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
DRD3 P35462 1/20 0.33
GRM2 Q14416 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
HRH3 Q9Y5N1 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
SCHEMBL18136193 0.82 POLB (0.52) POLBALDH1A1KDM4ESMN1; SMN2MAOB
SCHEMBL16593897 0.81 POLB (0.48) POLBALDH1A1SMN1; SMN2CYP1A2CYP2C19
SCHEMBL19974042 0.81 POLB (0.48) POLBALDH1A1KDM4ESMN1; SMN2CYP1A2
SCHEMBL20189025 0.80 POLB (0.46) POLBALDH1A1KDM4ESMN1; SMN2CYP1A2
SCHEMBL22901345 0.78 POLB (0.52) POLBALDH1A1KDM4EMETRAB9A
SCHEMBL18506073 0.78 POLB (0.46) POLBALDH1A1KDM4ESMN1; SMN2MAOB
SCHEMBL31141582 0.77 POLB (0.48) POLBALDH1A1KDM4ESMN1; SMN2MET
SCHEMBL23507228 0.76 POLB (0.50) POLBALDH1A1SMN1; SMN2METDRD2
SCHEMBL19711948 0.76 POLB (0.47) POLBALDH1A1KDM4ESMN1; SMN2CYP1A2
SCHEMBL19711951 0.76 POLB (0.47) POLBALDH1A1KDM4ESMN1; SMN2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10986840-B2 2-(het)aryl-substituted fused heterocycle derivatives as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2021-04-27 US disclosed
CN-108884091-B Condensed heterocyclic compound and pest control agent 日产化学株式会社 2021-04-13 CN disclosed
EP-3766881-A1 HETEROARYL PYRIMIDINE COMPOUND AND PEST CONTROL AGENT Nippon Soda Co., Ltd. (JP) 2021-01-20 EP disclosed
US-10765116-B2 2-[3-(alkylsulfonyl)-2H-indazol-2-yl]-3H-imidazo[4,5-B]pyridine derivatives and similar compounds as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-09-08 US disclosed
US-10759815-B2 Condensed heterocyclic compounds and pesticides NISSAN CHEMICAL CORPORATION (JP) 2020-09-01 US disclosed
US-20200223868-A1 CONDENSED HETEROCLYCLIC COMPOUNDS AND PESTICIDES NISSAN CHEMICAL CORPORATION (JP) 2020-07-16 US disclosed
US-10667517-B2 2-(Het)aryl-substituted fused heterocycle derivatives as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-06-02 US disclosed
US-10640518-B2 Condensed heterocyclic compounds and pesticides NISSAN CHEMICAL CORPORATION (JP) 2020-05-05 US disclosed
US-20200095263-A1 CONDENSED HETEROCYCLIC COMPOUNDS AND PESTICIDES NISSAN CHEMICAL CORPORATION (JP) 2020-03-26 US disclosed
US-10561145-B2 Fused bicyclic heterocycle derivatives as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-02-18 US disclosed
US-20200029567-A1 2-(Het)aryl-substituted fused heterocycle derivatives as pesticides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2020-01-30 US disclosed
US-10544163-B2 Condensed heterocyclic compounds and pesticides NISSAN CHEMICAL CORPORATION (JP) 2020-01-28 US disclosed
US-20190274306-A1 2-[3-(ALKYLSULFONYL)-2H-INDAZOL-2-YL]-3H-IMIDAZO[4,5-B]PYRIDINE DERIVATIVES AND SIMILAR COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-09-12 US disclosed
US-20190239510-A1 FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2019-08-08 US disclosed
EP-3428166-A1 CONDENSED HETEROCYCLIC COMPOUND AND PEST CONTROL AGENT Nissan Chemical Corporation (JP) 2019-01-16 EP 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 (12 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-10667517-B2 2-(Het)aryl-substituted fused heterocycle derivatives as pesticides CYP1A1, CYP8B1, CYP1B1 POLB 4837/4885ALDH1A1 268/4885KDM4E 2736/4885
US-20190274306-A1 2-[3-(ALKYLSULFONYL)-2H-INDAZOL-2-YL]-3H-IMIDAZO[4,5-B]PYRIDINE DERIVATIVES AND SIMILAR COMPOUNDS AS PESTICIDES API5, ACHE, ATXN2 POLB 4844/4885ALDH1A1 989/4885KDM4E 1034/4885
US-20190239510-A1 FUSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES DDT, ACHE, BCHE POLB 4096/4885ALDH1A1 264/4885KDM4E 2452/4885
US-20200029567-A1 2-(Het)aryl-substituted fused heterocycle derivatives as pesticides CYP1A1, CYP8B1, CYP1B1 POLB 4837/4885ALDH1A1 268/4885KDM4E 2736/4885
US-10759815-B2 Condensed heterocyclic compounds and pesticides NR4A1, CHRM1, NR1D2 POLB 4343/4885ALDH1A1 1097/4885KDM4E 3067/4885
US-10986840-B2 2-(het)aryl-substituted fused heterocycle derivatives as pesticides CYP1A1, CYP8B1, CYP1B1 POLB 4837/4885ALDH1A1 268/4885KDM4E 2736/4885
US-10765116-B2 2-[3-(alkylsulfonyl)-2H-indazol-2-yl]-3H-imidazo[4,5-B]pyridine derivatives and similar compounds as pesticides API5, ACHE, ATXN2 POLB 4844/4885ALDH1A1 989/4885KDM4E 1034/4885
US-20200223868-A1 CONDENSED HETEROCLYCLIC COMPOUNDS AND PESTICIDES CHRM1, HCRTR1, NR4A1 POLB 4742/4885ALDH1A1 707/4885KDM4E 3647/4885
US-10544163-B2 Condensed heterocyclic compounds and pesticides NR4A1, CHRM1, NR1D2 POLB 4393/4885ALDH1A1 1147/4885KDM4E 3163/4885
US-10561145-B2 Fused bicyclic heterocycle derivatives as pesticides DDT, ACHE, BCHE POLB 4096/4885ALDH1A1 264/4885KDM4E 2452/4885
US-20200095263-A1 CONDENSED HETEROCYCLIC COMPOUNDS AND PESTICIDES NR4A1, CHRM1, NR1D2 POLB 4393/4885ALDH1A1 1147/4885KDM4E 3163/4885
US-10640518-B2 Condensed heterocyclic compounds and pesticides NR4A1, CHRM1, NR1D2 POLB 4297/4885ALDH1A1 1121/4885KDM4E 3056/4885

“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.