SCHEMBL28405283

SCHEMBL28405283

O=C(O)c1cccc(Cl)c1-n1cncn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
ALDH1A1 P00352 2/20 0.44
NOTUM Q6P988 1/20 0.42
KCNJ5 P48544 1/20 0.41
KCNJ3 P48549 1/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
STING1 Q86WV6 1/20 0.39
MAPT P10636 2/20 0.38
PBRM1 Q86U86 1/20 0.37
POLB P06746 1/20 0.37
LMNA P02545 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HCAR2 Q8TDS4 1/20 0.36
USP2 O75604 1/20 0.36
MT-CO2 P00403 1/20 0.36
TTR P02766 1/20 0.36
PLA2G1B P04054 1/20 0.36
CYP1A2 P05177 1/20 0.36
PGR P06401 1/20 0.36

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
SCHEMBL28608913 0.89 POLB (0.41) TSHRALDH1A1KMT2ASTING1MAPT
SCHEMBL28184030 0.82 POLB (0.43) ALDH1A1STING1MAPTPOLBLMNA
SCHEMBL21816306 0.82 POLB (0.46) ALDH1A1KMT2AMEN1STING1POLB
SCHEMBL31175286 0.82 POLB (0.46) ALDH1A1KMT2AMEN1STING1POLB
SCHEMBL10765457 0.82 KCNJ5 (0.46) ALDH1A1KCNJ5KCNJ3KMT2AMEN1
Pyridine SCHEMBL16720239 0.77 CYP2A6 (0.35) ALDH1A1STING1MAPTPOLBSMN1; SMN2
SCHEMBL19585006 0.77 TSHR (0.47) TSHRALDH1A1NOTUMKMT2AMEN1
SCHEMBL16720215 0.76 ADORA3 (0.36) ALDH1A1STING1MAPTPOLBADORA3
SCHEMBL28397579 0.76 KMT2A (0.41) ALDH1A1KMT2AMEN1MAPTPBRM1
SCHEMBL3659233 0.75 NPC1 (0.41) ALDH1A1KMT2APOLBLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12528780-B2 2-(1,2,4-triazolyl) benzoyl arylamine active compound for inhibiting wheat take-all pathogen HENAN AGRICULTURAL UNIVERSITY (CN) 2026-01-20 US disclosed
US-20220348550-A1 2-(1,2,4-TRIAZOLYL) BENZOYL ARYLAMINE ACTIVE COMPOUND FOR INHIBITING WHEAT TAKE-ALL PATHOGEN HENAN AGRICULTURAL UNIVERSITY (CN) 2022-11-03 US disclosed
CN-111187227-B 2- (1,2, 4-triazole) benzoyl arylamine active compound for inhibiting wheat take-all disease bacteria 河南农业大学 2020-10-23 CN disclosed
CN-111187227-A 2- (1,2, 4-triazole) benzoyl arylamine active compound for inhibiting wheat take-all disease bacteria 河南农业大学 2020-05-22 CN 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-20220348550-A1 2-(1,2,4-TRIAZOLYL) BENZOYL ARYLAMINE ACTIVE COMPOUND FOR INHIBITING WHEAT TAKE-ALL PATHOGEN THEM6, HRH4, CBR3 TSHR 749/4885ALDH1A1 3780/4885NOTUM 115/4885
US-12528780-B2 2-(1,2,4-triazolyl) benzoyl arylamine active compound for inhibiting wheat take-all pathogen CBR3, GET3, HRH4 TSHR 554/4885ALDH1A1 3980/4885NOTUM 225/4885

“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.