SCHEMBL29368606

SCHEMBL29368606

CC(=O)OCCN(C)c1ccc(C=O)c(OCc2ccccc2)c1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.43
HDAC8 Q9BY41 1/20 0.42
ALDH1A1 P00352 3/20 0.42
ERN1 O75460 2/20 0.40
LTB4R Q15722 2/20 0.38
LTB4R2 Q9NPC1 1/20 0.38
BRD4 O60885 2/20 0.38
EGFR P00533 1/20 0.38
APP P05067 2/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
TSHR P16473 1/20 0.38
STAT3 P40763 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
PTPN1 P18031 1/20 0.37
MCHR1 Q99705 1/20 0.37

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
SCHEMBL20954298 1.00 BACE1 (0.43) BACE1HDAC8ALDH1A1ERN1LTB4R
SCHEMBL21191517 0.90 BACE1 (0.48) BACE1HDAC8ALDH1A1ERN1BRD4
SCHEMBL10008801 0.89 BACE1 (0.41) BACE1HDAC8ALDH1A1ERN1LTB4R
SCHEMBL20954376 0.85 BACE1 (0.44) BACE1HDAC8ALDH1A1ERN1LTB4R
SCHEMBL20954422 0.85 ALDH1A1 (0.39) ALDH1A1MTNR1AMTNR1BMCHR1
SCHEMBL29371660 0.85 ALDH1A1 (0.39) ALDH1A1MTNR1AMTNR1BMCHR1
SCHEMBL21191502 0.85 BACE1 (0.46) BACE1HDAC8ALDH1A1ERN1BRD4
SCHEMBL29368301 0.82 BACE1 (0.46) BACE1HDAC8ALDH1A1ERN1APP
SCHEMBL10009902 0.82 BACE1 (0.46) BACE1HDAC8ALDH1A1ERN1APP
SCHEMBL27237675 0.80 BACE1 (0.48) BACE1HDAC8ALDH1A1ERN1LTB4R

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
EP-3480224-B1 ELECTRO-OPTIC POLYMER NAT INST INF & COMM TECH (JP) 2024-06-12 EP disclosed
US-11236188-B2 Electro-optic polymer NATIONAL INSTITUTE OF INFORMATION AND COMMUNICATIONS TECHNOLOGY (JP) 2022-02-01 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-11236188-B2 Electro-optic polymer UACA, ELAVL1, EYA3 BACE1 4855/4885HDAC8 2005/4885ALDH1A1 216/4885

“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.