SCHEMBL4910282

SCHEMBL4910282

OCc1ccc(-c2cc3ccccc3s2)cc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.67
HSD17B1 P14061 2/20 0.55
HSD17B2 P37059 2/20 0.55
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
CYP2A6 P11509 2/20 0.53
ERN1 O75460 3/20 0.50
ESR1 P03372 4/20 0.47
ESR2 Q92731 4/20 0.47
HDAC2 Q92769 1/20 0.43
CD274 Q9NZQ7 1/20 0.43
EGFR P00533 2/20 0.42
RIPK1 Q13546 1/20 0.41
ASIC3 Q9UHC3 1/20 0.41
LOXL2 Q9Y4K0 1/20 0.41
MGLL Q99685 1/20 0.41

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
SCHEMBL16675744 0.87 HSD17B1 (0.60) APPHSD17B1HSD17B2CA1CA2
SCHEMBL32677328 0.85 APP (0.81) APPHSD17B1HSD17B2CA1CA2
SCHEMBL27159530 0.85 APP (0.81) APPHSD17B1HSD17B2CA1CA2
SCHEMBL28357616 0.84 APP (0.69) APPHSD17B1HSD17B2CA1CA2
SCHEMBL4909636 0.83 APP (0.62) APPHSD17B1HSD17B2CA1CA2
SCHEMBL13766429 0.83 APP (0.62) APPHSD17B1HSD17B2CA1CA2
SCHEMBL16021770 0.82 APP (0.47) APPHSD17B1HSD17B2CA1CA2
Alcohol SCHEMBL28260373 0.81 APP (0.64) APPHSD17B1HSD17B2CA1CA2
SCHEMBL6172601 0.80 APP (1.00) APPHSD17B1HSD17B2CA1CA2
SCHEMBL23555697 0.80 APP (0.72) APPHSD17B1HSD17B2CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080299041-A1 HETEROCYCLIC INDENE DERIVATIVES AND THEIR RADIOISOTOPE LABELED COMPOUNDS FOR IMAGING BETA-AMYLOID DEPOSITION SEOUL NATIONAL UNIVERSITY INDUSTRY FOUNDATION (KR) 2008-12-04 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-20080299041-A1 HETEROCYCLIC INDENE DERIVATIVES AND THEIR RADIOISOTOPE LABELED COMPOUNDS FOR IMAGING BETA-AMYLOID DEPOSITION APP, BACE1, PSEN1 APP 1/4885HSD17B1 483/4885HSD17B2 621/4885

“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.