SCHEMBL3745747

SCHEMBL3745747

CSc1ncc2c(n1)OC(c1ccccc1)CN(C)C2=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SLC6A2 P23975 5/20 0.35
CACNA2D1 P54289 5/20 0.35
ALOX5 P09917 1/20 0.35
ALDH1A1 P00352 3/20 0.34
BRD4 O60885 3/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
CCNA2 P20248 1/20 0.32
CDK2 P24941 1/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
NTRK1 P04629 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
AR P10275 1/20 0.32

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
SCHEMBL3745029 0.81 RIPK1 (0.36) ALOX5ALDH1A1BRD4HPGDTSHR
SCHEMBL3746753 0.76 MAOB (0.36) ALOX5BRD4KDM4EADORA3AR
SCHEMBL3745800 0.71 NOS2 (0.43) ALDH1A1CYP1A2CYP2C9HPGDTSHR
SCHEMBL7364885 0.68 FADS1 (0.50) ALOX5BRD4TSHRKDM4EADORA3
SCHEMBL7364886 0.68 FADS1 (0.50) ALOX5BRD4TSHRKDM4EADORA3
SCHEMBL5835616 0.68 FADS1 (0.50) ALOX5BRD4TSHRKDM4EADORA3
SCHEMBL20874122 0.67 WEE1 (0.55) KDM4E
SCHEMBL9298467 0.66 FGFR4 (0.36) MEN1KMT2ASLC6A2CACNA2D1ALDH1A1
SCHEMBL3741085 0.65 IMPDH2 (0.41) KMT2AALDH1A1BRD4CYP2C9KDM4E
SCHEMBL30879301 0.65 MAPT (0.37) MEN1KMT2ASLC6A2CACNA2D1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010132015-A1 NEW COMPOUNDS MODULATING GAMMA-SECRETASE AND THEIR USE IN THE TREATMENT OF ALPHA BETA RELATED PATHOLOGIES, SUCH AS ALZHEIMER'S DISEASE ASTRAZENECA AB (SE) 2010-11-18 WO disclosed
WO-2010132015-A1 NEW COMPOUNDS MODULATING GAMMA-SECRETASE AND THEIR USE IN THE TREATMENT OF ALPHA BETA RELATED PATHOLOGIES, SUCH AS ALZHEIMER'S DISEASE ASTRAZENECA AB (SE) 2010-11-18 WO disclosed
US-20100292210-A1 Novel Compounds for A-Beta-Related Pathologies ASTRAZENECA AB (SE) 2010-11-18 US disclosed
US-20100292210-A1 Novel Compounds for A-Beta-Related Pathologies ASTRAZENECA AB (SE) 2010-11-18 US disclosed
US-20100292210-A1 Novel Compounds for A-Beta-Related Pathologies ASTRAZENECA AB (SE) 2010-11-18 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-20100292210-A1 Novel Compounds for A-Beta-Related Pathologies BACE1, APP, BACE2 MEN1 2774/4885KMT2A 4527/4885SLC6A2 3599/4885

“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.