SCHEMBL5169940

SCHEMBL5169940

CSc1ccc(NC(=S)CC(N)=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.56
MAPT P10636 3/20 0.48
RAB9A P51151 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
NPC1 O15118 2/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 4/20 0.47
LMNA P02545 2/20 0.47
NOX1 Q9Y5S8 1/20 0.47
FPR2 P25090 5/20 0.47
MAPK1 P28482 1/20 0.43
PTGS2 P35354 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
EPHX2 P34913 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
SCHEMBL2755846 0.78 PEPD (0.57) IDO1MAPTRAB9AMEN1KMT2A
SCHEMBL5521712 0.78 IDO1 (0.67) IDO1MAPTRAB9AMEN1KMT2A
SCHEMBL5146332 0.77 ALDH1A1 (0.60) IDO1MAPTMEN1KMT2AALDH1A1
SCHEMBL3069525 0.77 ALDH1A1 (0.57) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL6390723 0.74 CA1 (0.54) IDO1MAPTRAB9AMEN1KMT2A
SCHEMBL27644436 0.72 ALDH1A1 (0.58) IDO1MAPTRAB9AMEN1KMT2A
SCHEMBL3074944 0.72 ALDH1A1 (0.70) IDO1MAPTRAB9AMEN1KMT2A
SCHEMBL836968 0.72 ALDH1A1 (0.62) IDO1MAPTRAB9AMEN1KMT2A
SCHEMBL5170073 0.72 KMT2A (0.51) MAPTRAB9AMEN1KMT2ANPC1
SCHEMBL17913053 0.72 IDO1 (1.00) IDO1MAPTMEN1KMT2AKDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7288556-B2 Antiproliferative 1,2,3-thiadiazole compounds QLT INC. (CA) 2007-10-30 US disclosed
US-7022702-B2 Antiproliferative 1,2,3-thiadiazole compounds QLT INC. (CA) 2006-04-04 US disclosed
US-20060009500-A1 Antiproliferative 1,2,3-thiadiazole compounds QLT INC. (CA) 2006-01-12 US disclosed
US-20030096848-A1 Antiproliferative 1,2,3-thiadiazole compounds DERMIRA (CANADA), INC. 2003-05-22 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 (2 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-20030096848-A1 Antiproliferative 1,2,3-thiadiazole compounds CCNA1, CCND1, CCND3 IDO1 241/4885MAPT 4864/4885RAB9A 4479/4885
US-20060009500-A1 Antiproliferative 1,2,3-thiadiazole compounds CCNA1, CCND3, ACIN1 IDO1 897/4885MAPT 4790/4885RAB9A 3543/4885

“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.