SCHEMBL6447047

SCHEMBL6447047

O=C(Nc1ccc(-n2nccn2)cc1)c1ccc(C(=O)Nc2nnc(-c3cc(Cl)cc(Cl)c3O)s2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ LMNA P02545 2/20 0.40
▸ F10 P00742 1/20 0.39
▸ PTGER3 P43115 3/20 0.39
▸ PTGS1 P23219 1/20 0.38
▸ TBXAS1 P24557 1/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ MAPK14 Q16539 1/20 0.38
▸ MAPT P10636 4/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ ACLY P53396 1/20 0.38
▸ TAS1R3 Q7RTX0 1/20 0.38
▸ TAS1R1 Q7RTX1 1/20 0.38
▸ TAS1R2 Q8TE23 1/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ HTT P42858 1/20 0.38
▸ BLM P54132 1/20 0.38

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
SCHEMBL6329492 0.89 BLM (0.45) KDM4EALDH1A1LMNAMAPTKMT2A
SCHEMBL6447202 0.88 KMT2A (0.46) KDM4EMAPK1PTGER3PTGS1TBXAS1
SCHEMBL6445978 0.87 SNCA (0.47) KDM4EMAPK1ALDH1A1LMNAPTGER3
SCHEMBL6449271 0.86 LMNA (0.45) KDM4EMAPK1ALDH1A1LMNAF10
SCHEMBL6448563 0.86 F10 (0.42) KDM4EMAPK1ALDH1A1LMNAF10
SCHEMBL6447053 0.86 CSNK2A2 (0.49) KDM4EALDH1A1PTGER3MAPTKMT2A
SCHEMBL6445760 0.86 CSNK2A2 (0.52) KDM4EALDH1A1PTGER3MAPTKMT2A
SCHEMBL6444272 0.85 RXFP1 (0.48) KDM4EMAPK1ALDH1A1LMNAMAPT
SCHEMBL6445816 0.85 BCAT2 (0.49) KDM4EMAPK1LMNAPTGER3PTGS1
SCHEMBL6444242 0.85 RAB9A (0.52) KDM4EALDH1A1LMNAPTGER3MAPT

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 2 patents. 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 claimed
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 KDM4E 4375/4885MAPK1 470/4885ALDH1A1 212/4885

“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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