SCHEMBL6446115

SCHEMBL6446115

O=[N+]([O-])c1ccc(-n2cncn2)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.49
HSP90AA1 P07900 1/20 0.47
ATM Q13315 1/20 0.47
MAPT P10636 5/20 0.47
GAA P10253 2/20 0.47
ALDH1A1 P00352 10/20 0.46
LMNA P02545 5/20 0.46
KMT2A Q03164 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MEN1 O00255 2/20 0.46
HPGD P15428 1/20 0.46
MAPK1 P28482 1/20 0.43

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
SCHEMBL2659793 0.82 CYP1A2 (0.51) HSP90AA1ATMMAPTALDH1A1LMNA
SCHEMBL7933915 0.82 GPR35 (0.46) HSP90AA1ATMMAPTGAAALDH1A1
SCHEMBL6448588 0.82 ALDH1A1 (0.49) MAPTALDH1A1KMT2ASMN1; SMN2MAPK1
SCHEMBL31285140 0.79 TSHR (0.49) MAPTALDH1A1LMNAKMT2AMEN1
SCHEMBL3156146 0.79 LMNA (0.57) HSP90AA1ATMMAPTGAAALDH1A1
SCHEMBL18146104 0.79 ALDH1A1 (0.54) HSP90AA1ATMMAPTGAAALDH1A1
SCHEMBL12306339 0.79 MAPT (0.42) HSP90AA1ATMMAPTALDH1A1KMT2A
SCHEMBL6179703 0.79 LMNA (0.51) MAPTALDH1A1LMNAKMT2ASMN1; SMN2
SCHEMBL31261399 0.79 ALDH1A1 (0.54) HSP90AA1ATMMAPTGAAALDH1A1
SCHEMBL29718848 0.78 CA2 (0.44) MAPTALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050143384-A1 Amide thiadiazole inhibitors of plasminogen activator inhibitor-1 BRISTOL-MYERS SQUIBB COMPANY 2005-06-30 US 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-20050143384-A1 Amide thiadiazole inhibitors of plasminogen activator inhibitor-1 SERPINE1, SERPINC1, SERPINB1 HSD17B10 1589/4885HSP90AA1 1354/4885ATM 1322/4885

“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.