SCHEMBL6978056

SCHEMBL6978056

CC1=CC(=O)CC(c2ccsc2)N1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
POLB P06746 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PKM P14618 1/20 0.40
ADORA2B P29275 16/20 0.39
MAPK1 P28482 1/20 0.36
MCL1 Q07820 1/20 0.36
CYP19A1 P11511 1/20 0.35

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
SCHEMBL6979945 0.77 BRD4 (0.45) ALDH1A1POLBSMN1; SMN2MAPK1
SCHEMBL6982349 0.74 POLB (0.46) ALDH1A1POLBSMN1; SMN2MAPK1
SCHEMBL6978724 0.72 MAPT (0.48) ALDH1A1POLBPKMADORA2B
SCHEMBL28343399 0.71 ALDH1A1 (0.40) ALDH1A1POLBSMN1; SMN2PKMADORA2B
SCHEMBL6985757 0.70 MAPT (0.43) ALDH1A1MCL1
SCHEMBL6978662 0.70 MAPT (0.43) ALDH1A1MCL1
SCHEMBL6981391 0.70 MAPT (0.43) ALDH1A1MCL1
SCHEMBL28346706 0.67 PKM (0.39) ALDH1A1POLBSMN1; SMN2PKMADORA2B
SCHEMBL6988020 0.67
SCHEMBL28346708 0.66 PKM (0.38) ALDH1A1POLBSMN1; SMN2PKMADORA2B

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
CN-1145612-C New 1- aza-2-alkyl-6-aryl-cyclanes compound, its producing process and medical composition containing them 2004-04-14 CN disclosed
EP-1050530-B1 1-Aza-2-alkyl-6-aryl-cycloalkanes usefull as memory enhancers SERVIER LAB (FR) 2003-10-22 EP disclosed
US-6451789-B1 CENTRAL NERVOUS SYSTEM DISORDERS; COGNITION ACTIVATORS LES LABORTOIRES SERVIER (FR) 2002-09-17 US disclosed
US-20020042413-A1 1-aza-2-alkyl-6-aryl-cycloalkanes RAULT SYLVAIN (FR) 2002-04-11 US disclosed
US-6323222-B1 COGNITION ACTIVATORS, ALZHEIMER*S DISEASE AND ENZYME INHIBITORS ADIR ET COMPAGNIE (FR) 2001-11-27 US disclosed
EP-1050530-A1 1-Aza-2-alkyl-6-aryl-cycloalkanes usefull as memory enhancers ADIR ET COMPAGNIE (FR) 2000-11-08 EP 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-20020042413-A1 1-aza-2-alkyl-6-aryl-cycloalkanes SULT2A1, GRIN2A, NR3C1 ALDH1A1 544/4885POLB 2282/4885SMN1; SMN2 682/4885

“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.