SCHEMBL20455829

SCHEMBL20455829

CCS(=O)(=O)c1ccc(-n2cc(Cl)cn2)nc1-c1nc2cc(C(F)(F)F)nc(C#N)c2n1C

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ KDM4E B2RXH2 3/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ HPGD P15428 3/20 0.34
▸ MAPT P10636 1/20 0.34
▸ DDR1 Q08345 3/20 0.31
▸ DRD2 P14416 1/20 0.31
▸ DRD3 P35462 1/20 0.31
▸ AR P10275 1/20 0.31
▸ EIF4EBP1 Q13541 1/20 0.30

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
SCHEMBL22419059 0.92 DDR1 (0.33) DDR1
SCHEMBL22280382 0.90 SMN1; SMN2 (0.37) SMN1; SMN2KDM4EALDH1A1HPGDMAPT
SCHEMBL20468526 0.86 ALDH1A1 (0.32) SMN1; SMN2KDM4EALDH1A1HPGDDDR1
SCHEMBL20455821 0.85 DDR1 (0.35) DDR1EIF4EBP1
SCHEMBL29521486 0.85 DDR1 (0.35) DDR1EIF4EBP1
SCHEMBL22280576 0.85 DDR1 (0.33) DDR1
SCHEMBL18506244 0.83 SMN1; SMN2 (0.35) SMN1; SMN2KDM4EALDH1A1HPGDMAPT
SCHEMBL31141512 0.83 SMN1; SMN2 (0.35) SMN1; SMN2KDM4EALDH1A1HPGDMAPT
SCHEMBL20465925 0.83 SMN1; SMN2 (0.33) SMN1; SMN2KDM4EALDH1A1HPGDMAPT
SCHEMBL18357558 0.83 DDR1 (0.34) SMN1; SMN2KDM4EALDH1A1HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110248941-B Aryl-or heteroaryl-substituted imidazopyridine derivatives and their use as pesticides 拜耳公司 2022-09-06 — — CN disclosed
US-10772332-B2 2-(het)aryl-substituted fused heterocycle derivatives as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2020-09-15 — — US disclosed
US-10772332-B2 2-(het)aryl-substituted fused heterocycle derivatives as pesticides BAYER AKTIENGESELLSCHAFT (DE) 2020-09-15 — — US disclosed
US-20200236940-A1 2-(HET)ARYL-SUBSTITUTED FUSED HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2020-07-30 — — US disclosed
US-20200236940-A1 2-(HET)ARYL-SUBSTITUTED FUSED HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2020-07-30 — — US disclosed
WO-2018141954-A1 ARYL OR HETEROARYL-SUBSTITUTED IMIDAZO PYRIDINE DERIVATIVES AND THEIR USE AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2018-08-09 — — WO disclosed
WO-2018141954-A1 ARYL OR HETEROARYL-SUBSTITUTED IMIDAZO PYRIDINE DERIVATIVES AND THEIR USE AS PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2018-08-09 — — 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 (2 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-10772332-B2 2-(het)aryl-substituted fused heterocycle derivatives as pesticides CYP4X1, CYP1A1, CYP1A2 SMN1; SMN2 2172/4885KDM4E 2601/4885ALDH1A1 591/4885
US-20200236940-A1 2-(HET)ARYL-SUBSTITUTED FUSED HETEROCYCLE DERIVATIVES AS PESTICIDES CYP4X1, CYP1A1, CYP1A2 SMN1; SMN2 2172/4885KDM4E 2601/4885ALDH1A1 591/4885

“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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