SCHEMBL6449332

SCHEMBL6449332

O=C(Nc1nnc(-c2cc(Cl)cc(Cl)c2O)s1)c1ccc(C(=O)Nc2cc(F)ccc2F)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.47
RAB9A P51151 5/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
KDM4E B2RXH2 2/20 0.47
CSNK2A2 P19784 1/20 0.47
CSNK2A1 P68400 1/20 0.47
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
TAS1R2 Q8TE23 1/20 0.46
RXFP1 Q9HBX9 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
LRRK2 Q5S007 1/20 0.44
ACLY P53396 2/20 0.43
ABL1 P00519 4/20 0.43
SRC P12931 4/20 0.43
KCNMA1 Q12791 1/20 0.42
MAPT P10636 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL6445872 0.89 NPC1 (0.53) NPC1RAB9ASMN1; SMN2KDM4ECSNK2A2
SCHEMBL6446020 0.86 KMT2A (0.48) NPC1RAB9ASMN1; SMN2KDM4ECSNK2A2
SCHEMBL6444549 0.85 NPC1 (0.46) NPC1RAB9ASMN1; SMN2KDM4ECSNK2A2
SCHEMBL6447131 0.85 ABL1 (0.46) NPC1RAB9ASMN1; SMN2KDM4ECSNK2A2
SCHEMBL6445844 0.85 ABL1 (0.48) NPC1RAB9ASMN1; SMN2KDM4ECSNK2A2
SCHEMBL6447140 0.84 PTGER3 (0.45) NPC1RAB9ASMN1; SMN2KDM4ECSNK2A2
SCHEMBL6451555 0.84 CSNK2A2 (0.55) NPC1RAB9ASMN1; SMN2KDM4ECSNK2A2
SCHEMBL6445925 0.83 MAPT (0.53) NPC1RAB9ASMN1; SMN2KDM4ECSNK2A2
SCHEMBL6447202 0.83 KMT2A (0.46) NPC1RAB9ASMN1; SMN2KDM4EMEN1
SCHEMBL6449394 0.82 TAS1R3 (0.49) NPC1RAB9ASMN1; SMN2KDM4ETAS1R3

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 NPC1 1404/4885RAB9A 1792/4885SMN1; SMN2 2751/4885

“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.