SCHEMBL6033024

SCHEMBL6033024

COc1ccc(SC2=NCCCS2)cc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.48
LMNA P02545 2/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
PTGIR P43119 11/20 0.47
HAO1 Q9UJM8 1/20 0.40
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL6033504 0.90 KMT2A (0.57) KMT2ALMNAALDH1A1MAPTMEN1
SCHEMBL6033461 0.79 MAPT (0.39) KMT2ALMNAALDH1A1MAPTMEN1
SCHEMBL6033404 0.78 ALDH1A1 (0.41) KMT2ALMNAALDH1A1MAPTMEN1
SCHEMBL6032247 0.78 NOS3 (0.35) KMT2ALMNAALDH1A1MAPTMEN1
SCHEMBL6032664 0.78 TSHR (0.43) KMT2ALMNAMAPTMEN1HSD17B10
SCHEMBL6033318 0.78 SMN1; SMN2 (0.36) KMT2ALMNAALDH1A1MAPTMEN1
SCHEMBL6033067 0.78 ALDH1A1 (0.41) KMT2ALMNAALDH1A1MAPTSMN1; SMN2
SCHEMBL6033133 0.77 PTGIR (0.43) KMT2ALMNAALDH1A1MAPTMEN1
SCHEMBL21649530 0.72 MAPT (0.58) KMT2ALMNAALDH1A1MAPTMEN1
SCHEMBL6032640 0.72 GFER (0.52) KMT2ALMNAALDH1A1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7084137-B2 Thiazines and thiazoles as agents for protecting materials BAYER AKTIENGESELLSCHAFT (DE) 2006-08-01 US claimed
US-20040204405-A1 Thiazines and thiazoles as agents for protecting materials LANXESS DEUTSCHLAND GMBH (DE) 2004-10-14 US claimed
US-20030129081-A1 Thiazines and thiazoles as agents for protecting materials BAYER AKTIENGESELLSCHAFT (DE) 2003-07-10 US claimed
US-7084137-B2 Thiazines and thiazoles as agents for protecting materials BAYER AKTIENGESELLSCHAFT (DE) 2006-08-01 US disclosed
US-20040204405-A1 Thiazines and thiazoles as agents for protecting materials LANXESS DEUTSCHLAND GMBH (DE) 2004-10-14 US disclosed
US-20030129081-A1 Thiazines and thiazoles as agents for protecting materials BAYER AKTIENGESELLSCHAFT (DE) 2003-07-10 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-20030129081-A1 Thiazines and thiazoles as agents for protecting materials POT1, NAT1, GPX1 KMT2A 4152/4885LMNA 1715/4885ALDH1A1 40/4885
US-20040204405-A1 Thiazines and thiazoles as agents for protecting materials POT1, NAT1, GPX1 KMT2A 4152/4885LMNA 1715/4885ALDH1A1 40/4885

“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.