SCHEMBL2310682

SCHEMBL2310682

CC(=O)Oc1ccc(C(=O)CCC(=O)O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.59
ELANE P08246 1/20 0.58
HSD17B10 Q99714 2/20 0.56
PDE4B Q07343 1/20 0.56
CYP1A2 P05177 2/20 0.55
ALDH1A1 P00352 2/20 0.55
CYP2C19 P33261 2/20 0.55
HPGD P15428 1/20 0.55
NR4A2 P43354 1/20 0.55
USP5 P45974 1/20 0.54
RAB9A P51151 3/20 0.53
LMNA P02545 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
FFAR1 O14842 1/20 0.53
HIF1A Q16665 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
GAA P10253 1/20 0.50
HTT P42858 1/20 0.47
NPC1 O15118 2/20 0.47
MMP2 P08253 1/20 0.46

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
SCHEMBL27637403 0.92 KMT2A (0.51) KMT2AELANEHSD17B10PDE4BCYP1A2
Acetic Acid Phenyl Ester SCHEMBL30176020 0.90 NR4A2 (0.67) KMT2AELANEHSD17B10CYP1A2ALDH1A1
SCHEMBL8655921 0.84 ELANE (0.59) KMT2AELANEHSD17B10PDE4BALDH1A1
SCHEMBL503582 0.81 PDE4B (0.80) KMT2AHSD17B10PDE4BCYP1A2ALDH1A1
SCHEMBL10885925 0.81 NR4A2 (0.63) KMT2AHSD17B10PDE4BCYP1A2ALDH1A1
SCHEMBL9049629 0.80 NPC1 (0.74) KMT2AELANEHSD17B10ALDH1A1RAB9A
SCHEMBL10353454 0.80 NR4A2 (0.81) KMT2AHSD17B10PDE4BCYP1A2ALDH1A1
SCHEMBL11390053 0.79 ELANE (0.58) KMT2AELANEHSD17B10ALDH1A1RAB9A
SCHEMBL11876667 0.79 ELANE (0.58) KMT2AELANEHSD17B10ALDH1A1RAB9A
SCHEMBL9733951 0.79 KMT2A (0.51) KMT2AHSD17B10PDE4BCYP1A2ALDH1A1

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-20110250135-A1 Piperazine Derivatives for Binding and Imaging Amyloid Plaques and Their Use BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-10-13 US disclosed
EP-2350000-A1 PIPERAZINE DERIVATIVES FOR BINDING AND IMAGING AMYLOID PLAQUES AND THEIR USE Bayer Schering Pharma Aktiengesellschaft (DE) 2011-08-03 EP disclosed
WO-2010028776-A1 PIPERAZINE DERIVATIVES FOR BINDING AND IMAGING AMYLOID PLAQUES AND THEIR USE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2010-03-18 WO disclosed
EP-2163541-A1 Piperazine derivatives for binding and imaging amyloid plaques and their use Bayer Schering Pharma Aktiengesellschaft (DE) 2010-03-17 EP 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-20110250135-A1 Piperazine Derivatives for Binding and Imaging Amyloid Plaques and Their Use APP, APBA1, PSEN1 KMT2A 4443/4885ELANE 1915/4885HSD17B10 3948/4885

“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.