SCHEMBL6445904

SCHEMBL6445904

N#Cc1cccc(NC(=O)c2ccc(C(=O)Nc3nnc(-c4cc(Cl)cc(Cl)c4O)s3)cc2)c1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.49
P2RX1 P51575 1/20 0.49
NAMPT P43490 1/20 0.45
MAPK14 Q16539 4/20 0.44
GRM4 Q14833 1/20 0.44
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
ESRRG P62508 1/20 0.42
PTGER3 P43115 1/20 0.42
NR1H4 Q96RI1 1/20 0.42
EPAS1 Q99814 1/20 0.42
BRAF P15056 1/20 0.42

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
SCHEMBL6444557 0.88 NPC1 (0.50) P2RX1NAMPTPTGER3
SCHEMBL6447053 0.86 CSNK2A2 (0.49) TP53MAPTPTGER3
SCHEMBL6445844 0.85 ABL1 (0.48) MAPTPTGER3
SCHEMBL6444705 0.84 MAPK1 (0.57) BLMMAPK14TP53MAPT
SCHEMBL6445760 0.84 CSNK2A2 (0.52) TP53MAPTPTGER3
SCHEMBL6447202 0.84 KMT2A (0.46) BLMMAPK14MAPTPTGER3
SCHEMBL6445643 0.83 CSNK2A2 (0.46) TP53MAPTPTGER3
SCHEMBL6448936 0.83 KMT2A (0.51) GRM4TP53MAPTPTGER3NR1H4
SCHEMBL6445978 0.83 SNCA (0.47) MAPK14PTGER3
SCHEMBL6446020 0.82 KMT2A (0.48) MAPTPTGER3

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 BLM 3997/4885P2RX1 2969/4885NAMPT 318/4885

“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.