SCHEMBL3754378

SCHEMBL3754378

CC(C)OCC(O)CNCc1ccc(Cl)nc1Cl

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 10/20 0.43
PDCD1LG2 Q9BQ51 9/20 0.43
MEN1 O00255 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
CASR P41180 1/20 0.36
NR2E1 Q9Y466 1/20 0.34
PDCD1 Q15116 1/20 0.33
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 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
SCHEMBL3703961 0.75 PDCD1LG2 (0.41) CD274PDCD1LG2
SCHEMBL3741159 0.74 PDCD1LG2 (0.38) CD274PDCD1LG2MEN1KMT2A
SCHEMBL3710213 0.72 PDCD1LG2 (0.37) CD274PDCD1LG2
SCHEMBL3747332 0.71 KDM4E (0.53) CD274PDCD1LG2KMT2AADRB2
SCHEMBL3706175 0.71 KDM4E (0.53) CD274PDCD1LG2KMT2AADRB2
SCHEMBL3718739 0.71 KDM4E (0.53) CD274PDCD1LG2KMT2AADRB2
SCHEMBL3717472 0.70 PDCD1LG2 (0.36) CD274PDCD1LG2MEN1KMT2A
SCHEMBL25868650 0.70 HPGD (0.52) MEN1HPGDKMT2AADRB2ADRB1
SCHEMBL3717469 0.69 LMNA (0.40) MEN1HPGDTSHRKMT2ANR2E1
SCHEMBL3743643 0.69 PDCD1LG2 (0.41) CD274PDCD1LG2MEN1HPGDKMT2A

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 4 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
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 CD274 4459/4885PDCD1LG2 3904/4885MEN1 2774/4885

“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.