SCHEMBL2446852

SCHEMBL2446852

O=C(CCC1CCCCC1)C1CN(C(=O)O)CCC1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.49
ITGA2B P08514 1/20 0.49
F2R P25116 1/20 0.49
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
HSD11B1 P28845 1/20 0.40
HPGD P15428 1/20 0.39
TP53 P04637 1/20 0.38
ALDH1A1 P00352 7/20 0.37
LMNA P02545 2/20 0.37
ATM Q13315 1/20 0.36
NAAA Q02083 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
MAPK1 P28482 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
HIF1A Q16665 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
TNKS O95271 1/20 0.33

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
SCHEMBL2449302 0.87 ITGB3 (0.39) ITGB3ITGA2BF2RKMT2AHPGD
SCHEMBL8905844 0.82 BACE1 (0.48) ITGB3ITGA2BF2RKMT2AMEN1
SCHEMBL2451557 0.81 ITGB3 (0.36) ITGB3ITGA2BF2RKMT2AMEN1
SCHEMBL2448504 0.75 GRM5 (0.35) ITGB3ITGA2BF2RTNKS2
SCHEMBL183476 0.73 ITGB3 (0.42) ITGB3ITGA2BF2R
SCHEMBL17847640 0.71 TLR4 (0.34) ITGB3ITGA2BF2RNPC1RAB9A
SCHEMBL28170568 0.71 ITGB3 (0.37) ITGB3ITGA2BF2R
SCHEMBL2842270 0.71 MAPT (0.44) KMT2AMEN1HPGDALDH1A1KDM4E
SCHEMBL4719202 0.71 ITGB3 (0.35) ITGB3ITGA2BF2RMAPK1
SCHEMBL4718414 0.71 ITGB3 (0.33) ITGB3ITGA2BF2R

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
US-8188101-B2 Dihydropyridopyrimidines for the treatment of AB-related pathologies ASTRAZENECA AB (SE) 2012-05-29 US disclosed
EP-2367826-A1 MODULATORS OF AMYLOID BETA. AstraZeneca AB (SE) 2011-09-28 EP disclosed
US-20100130495-A1 COMPOUNDS 563 ASTRAZENECA AB (SE) 2010-05-27 US disclosed
WO-2010053438-A1 MODULATORS OF AMYLOID BETA. ASTRAZENECA AB (SE) 2010-05-14 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-20100130495-A1 COMPOUNDS 563 BACE1, PSEN1, PSEN2 ITGB3 1627/4885ITGA2B 2468/4885F2R 1966/4885

“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.