SCHEMBL22561687

SCHEMBL22561687

C[C@H](Nc1nc2cc(Cl)cc(Cl)c2o1)C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
SCN9A Q15858 2/20 0.38
FFAR2 O15552 1/20 0.36
CETP P11597 1/20 0.35
PIK3CA P42336 2/20 0.35
ALOX5 P09917 1/20 0.34
ELANE P08246 2/20 0.34
THRB P10828 3/20 0.33
USP2 O75604 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GPR35 Q9HC97 1/20 0.33
AKR1B1 P15121 1/20 0.33
SYK P43405 1/20 0.33
F2 P00734 2/20 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
SCHEMBL22568477 0.87 HDAC3 (0.34) MAPTSCN9AFFAR2PIK3CAALOX5
SCHEMBL22561707 0.87 PIK3CA (0.34) MAPTSCN9APIK3CAALOX5ELANE
SCHEMBL22568463 0.84 SCN9A (0.33) SCN9APIK3CAELANESYKFPR2
SCHEMBL22568476 0.84 SCN9A (0.37) SCN9AFFAR2PIK3CAALOX5ELANE
SCHEMBL22568474 0.84 SCN9A (0.40) MAPTSCN9ACETPPIK3CAALOX5
SCHEMBL22561758 0.84 SCN9A (0.37) SCN9AFPR2
SCHEMBL22568395 0.83 PIK3CA (0.35) PIK3CATHRB
SCHEMBL22568467 0.81 SCN9A (0.42) MAPTSCN9AELANESYKFPR2
SCHEMBL22568464 0.81 HTR6 (0.40) ELANE
SCHEMBL22561698 0.78 HDAC8 (0.44) SCN9AFFAR2PIK3CAALOX5ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230046680-A1 NOVEL HETEROARYL-SUBSTITUTED AMINOALKYL AZOLE COMPOUNDS AS PESTICIDES ELANCO ANIMAL HEALTH GMBH (DE) 2023-02-16 US disclosed
WO-2020212235-A1 NOVEL HETEROARYL-SUBSTITUTED AMINOALKYL AZOLE COMPOUNDS AS PESTICIDES BAYER ANIMAL HEALTH GMBH (DE) 2020-10-22 WO disclosed
EP-3725788-A1 NOVEL HETEROARYL-SUBSTITUTED AMINOALKYL AZOLE COMPOUNDS AS PESTICIDES Bayer AG (DE) 2020-10-21 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 (1 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-20230046680-A1 NOVEL HETEROARYL-SUBSTITUTED AMINOALKYL AZOLE COMPOUNDS AS PESTICIDES DDT, CRY1, CYP4F3 MAPT 4067/4885SCN9A 1251/4885FFAR2 2695/4885

“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.