SCHEMBL14198059

SCHEMBL14198059

COc1ccc(C=C(C)C)cc1OCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 1/20 0.57
ALDH1A1 P00352 5/20 0.56
HPGD P15428 3/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
APP P05067 3/20 0.54
LMNA P02545 2/20 0.54
KMT2A Q03164 2/20 0.53
POLB P06746 1/20 0.53
UBE2N P61088 1/20 0.53
SMPD1 P17405 1/20 0.53
HDAC1 Q13547 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53
KDM4E B2RXH2 2/20 0.53
MAPT P10636 1/20 0.53
PDE4A P27815 1/20 0.52
PDE4B Q07343 1/20 0.52
PDE4C Q08493 1/20 0.52
PDE4D Q08499 1/20 0.52
MEN1 O00255 1/20 0.52

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
SCHEMBL14198065 0.94 HPGD (0.61) ALDH1A1HPGDAPPKMT2AKDM4E
SCHEMBL14198022 0.87 SMN1; SMN2 (0.59) ALDH1A1HPGDL3MBTL1LMNAKMT2A
SCHEMBL5350800 0.87 ALDH1A1 (0.58) AMY1AALDH1A1HPGDL3MBTL1APP
SCHEMBL5362058 0.87 ALDH1A1 (0.58) AMY1AALDH1A1HPGDL3MBTL1APP
SCHEMBL7354893 0.87 ALDH1A1 (0.58) AMY1AALDH1A1HPGDL3MBTL1APP
SCHEMBL4960972 0.87 APP (0.56) AMY1AALDH1A1HPGDL3MBTL1APP
SCHEMBL4960977 0.87 APP (0.56) AMY1AALDH1A1HPGDL3MBTL1APP
SCHEMBL5362060 0.87 ALDH1A1 (0.58) AMY1AALDH1A1HPGDL3MBTL1APP
SCHEMBL5350808 0.87 ALDH1A1 (0.58) AMY1AALDH1A1HPGDL3MBTL1APP
SCHEMBL7356814 0.87 ALDH1A1 (0.58) AMY1AALDH1A1HPGDL3MBTL1APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080096894-A1 Anti-Bacterial Compounds ASTON UNIVERSITY (GB) 2008-04-24 US disclosed
US-20080096894-A1 Anti-Bacterial Compounds ASTON UNIVERSITY (GB) 2008-04-24 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-20080096894-A1 Anti-Bacterial Compounds MRPL21, PGLS, FOSB AMY1A 927/4885ALDH1A1 3322/4885HPGD 1861/4885

“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.