SCHEMBL6447124

SCHEMBL6447124

COc1ccc(C(=O)Nc2nnc(-c3cc(Cl)cc(Cl)c3O)s2)cc1Br

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PTGER3 P43115 2/20 0.52
MEN1 O00255 5/20 0.49
KMT2A Q03164 5/20 0.49
RXFP1 Q9HBX9 2/20 0.49
TP53 P04637 2/20 0.47
KDM4E B2RXH2 3/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAPT P10636 5/20 0.46
RAB9A P51151 2/20 0.45
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
POLB P06746 1/20 0.44
NOX1 Q9Y5S8 1/20 0.43
NPC1 O15118 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
SCHEMBL6445774 0.91 PTGER3 (0.54) PTGER3MEN1KMT2ARXFP1TP53
SCHEMBL6445773 0.87 NPC1 (0.46) PTGER3MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL6448596 0.86 SMN1; SMN2 (0.52) PTGER3MEN1KMT2ARXFP1TP53
SCHEMBL6446057 0.85 ALDH1A1 (0.58) PTGER3MEN1KMT2ALMNAMAPT
SCHEMBL6449245 0.85 NPC1 (0.46) PTGER3MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL6448931 0.83 PTGER3 (0.46) PTGER3MEN1KMT2ARXFP1TP53
SCHEMBL6445925 0.83 MAPT (0.53) PTGER3MEN1KMT2ARXFP1TP53
SCHEMBL6448556 0.82 KDM4E (0.62) PTGER3MEN1KMT2ATP53KDM4E
SCHEMBL6445716 0.82 GLB1 (0.49) PTGER3MEN1KMT2AKDM4ELMNA
SCHEMBL6445474 0.82 KDM4E (0.53) PTGER3MEN1KMT2ARXFP1KDM4E

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 PTGER3 332/4885MEN1 1024/4885KMT2A 3566/4885

“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.