SCHEMBL3749775

SCHEMBL3749775

OCCN1Cc2ccc(Nc3ccc(-c4nnc5n4CCC5)cc3)nc2O[C@H](c2ccccc2)C1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 12/20 0.36
ALDH1A1 P00352 6/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 3/20 0.34
CNR2 P34972 5/20 0.34
MAPT P10636 3/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TP53 P04637 1/20 0.33
USP2 O75604 1/20 0.32
MAPK10 P53779 1/20 0.32
CYP3A4 P08684 1/20 0.31
PKM P14618 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAP3K5 Q99683 1/20 0.31

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
SCHEMBL3749779 1.00 HPGD (0.36) HPGDALDH1A1SMN1; SMN2LMNACNR2
SCHEMBL3745810 0.77 PSEN1 (0.42) CNR2
SCHEMBL3745817 0.77 PSEN1 (0.42) CNR2
SCHEMBL3746735 0.76 CNR2 (0.37) CNR2
SCHEMBL3746731 0.76 CNR2 (0.37) CNR2
SCHEMBL3751082 0.72 PSEN1 (0.42) HPGDALDH1A1CNR2MAPTKDM4E
SCHEMBL3751086 0.72 PSEN1 (0.42) HPGDALDH1A1CNR2MAPTKDM4E
SCHEMBL3740776 0.71 CNR2 (0.37) CNR2
SCHEMBL3740781 0.71 CNR2 (0.37) CNR2
SCHEMBL3740673 0.70 SLC18A3 (0.37) CNR2MEN1KMT2A

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 claimed
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 HPGD 2241/4885ALDH1A1 2384/4885SMN1; SMN2 443/4885

“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.