SCHEMBL3522806

SCHEMBL3522806

CCN1C(=S)NC(c2ccccc2)c2cc3c(cc21)OCCO3

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40
PKM P14618 1/20 0.38
ALDH1A1 P00352 4/20 0.38
ALOX12 P18054 2/20 0.38
KMT2A Q03164 3/20 0.38
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
GSK3B P49841 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
HTT P42858 1/20 0.34

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
SCHEMBL13548366 0.93 GSK3B (0.43) LMNAADORA3CA1CA2PKM
SCHEMBL13548369 0.79 LMNA (0.55) LMNAADORA3ALDH1A1GSK3BSMN1; SMN2
SCHEMBL11817708 0.75 LMNA (0.50) LMNAADORA3ALDH1A1KMT2ASMN1; SMN2
SCHEMBL11867921 0.73 ALDH1A1 (0.37) LMNACA1CA2ALDH1A1ALOX12
SCHEMBL11017764 0.70 LMNA (0.73) LMNAADORA3CA1CA2PKM
SCHEMBL3522021 0.68 GSK3B (0.48) LMNAADORA3ALDH1A1ALOX12KMT2A
SCHEMBL11478019 0.68 LMNA (0.48) LMNAADORA3ALDH1A1GSK3BSMN1; SMN2
SCHEMBL3523104 0.67 BRD4 (0.52) LMNAADORA3ALDH1A1KMT2APOLB
SCHEMBL11460061 0.67 CA1 (0.42) LMNACA1CA2PKMALDH1A1
SCHEMBL11724082 0.67 LMNA (0.39) LMNAADORA3ALDH1A1GSK3BSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7652006-B2 For therapy and prophylaxis of neuronal loss associated with stroke, global and focal ischemia, CNS trauma, hypoglycemia and surgery, for ameliorating neurodegenerative diseases EURO-CELTIQUE S.A. (LU) 2010-01-26 US disclosed
US-20040162299-A1 Substituted quinazolines and analogs and the use thereof EURO-CELTIQUE, S.A. 2004-08-19 US disclosed
US-6765006-B2 ANTAGONISTS OF AMINO-3-HYDROXY-5-METHYLISOXAZOLE-4-PROPIONIC ACID (AMPA) IONOTROPIC RECEPTORS; NEURODEGENERATIVE, ALZHEIMER'S, AND HUNTINGTON'S DISEASE; AMYOTROPHIC LATERAL SCLEROSIS; SCHIZOPHRENIA, EXCITATORY AMINO ACID DEFICIENCY EURO-CELTIQUE S.A. (LU) 2004-07-20 US disclosed
EP-1066039-A4 SUBSTITUTED QUINAZOLINES AND ANALOGS AND THE USE THEREOF COCENSYS INC (US) 2003-02-26 EP disclosed
US-20030033089-A1 Substituted quinazolines and analogs and the use thereof EURO-CELTIQUE S.A. 2003-02-13 US disclosed
US-6465472-B1 SUCH AS 1-(2-DIETHYLAMINOETHYL)-6,7-METHYLENEDIOXY-4-(3,4-METHYLENE -DIOXYPHENYL)QUINAZOLIN-2(1H)-ONE; AMPA IONOTROPIC RECEPTOR ANTAGONISTS; ANTICONVULSANTS, COGNITIVE ENHANCERS, PREVENTION OF NEURODEGENERATION EURO-CELTIQUE S.A. (LU) 2002-10-15 US disclosed
EP-1066039-A1 SUBSTITUTED QUINAZOLINES AND ANALOGS AND THE USE THEREOF Cocensys, Inc. (US) 2001-01-10 EP disclosed
WO-1999044612-A1 SUBSTITUTED QUINAZOLINES AND ANALOGS AND THE USE THEREOF COCENSYS, INC. (US) 1999-09-10 WO 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-20040162299-A1 Substituted quinazolines and analogs and the use thereof CHRNA7, CHRNA2, CHRNA10 LMNA 1204/4885ADORA3 1022/4885CA1 2841/4885

“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.