SCHEMBL6448596

SCHEMBL6448596

COc1ccc(NC(=O)c2ccc(C(=O)Nc3nnc(-c4cc(Cl)cc(Cl)c4O)s3)cc2)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 7/20 0.52
MAPT P10636 4/20 0.52
TP53 P04637 4/20 0.52
THRB P10828 1/20 0.52
NPC1 O15118 4/20 0.51
RAB9A P51151 4/20 0.51
LMNA P02545 2/20 0.50
PTGER3 P43115 1/20 0.49
STK39 Q9UEW8 3/20 0.48
MAOB P27338 1/20 0.48
KDM4E B2RXH2 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
RXFP1 Q9HBX9 1/20 0.47
GRM4 Q14833 1/20 0.47
USP2 O75604 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46

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 0.93 PTGER3 (0.54) SMN1; SMN2MAPTTP53THRBNPC1
SCHEMBL6444705 0.88 MAPK1 (0.57) SMN1; SMN2MAPTTP53NPC1RAB9A
SCHEMBL6447124 0.86 PTGER3 (0.52) SMN1; SMN2MAPTTP53NPC1RAB9A
SCHEMBL6448931 0.86 PTGER3 (0.46) SMN1; SMN2MAPTTP53NPC1RAB9A
SCHEMBL6447202 0.85 KMT2A (0.46) SMN1; SMN2MAPTTHRBNPC1RAB9A
SCHEMBL6444242 0.85 RAB9A (0.52) SMN1; SMN2MAPTTP53NPC1RAB9A
SCHEMBL6445978 0.84 SNCA (0.47) SMN1; SMN2NPC1RAB9ALMNAPTGER3
SCHEMBL6446020 0.84 KMT2A (0.48) SMN1; SMN2MAPTTHRBNPC1RAB9A
SCHEMBL6445474 0.84 KDM4E (0.53) SMN1; SMN2MAPTRAB9ALMNAPTGER3
SCHEMBL6448951 0.84 AKR1C4 (0.48) SMN1; SMN2MAPTNPC1RAB9ALMNA

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 SMN1; SMN2 2751/4885MAPT 3346/4885TP53 2663/4885

“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.