SCHEMBL3853493

SCHEMBL3853493

OCC[C@H](O)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.38
AOC3 Q16853 1/20 0.34
DRD4 P21917 3/20 0.33
GAA P10253 1/20 0.33
HTR1A P08908 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL3190903 1.00 TSHR (0.38) TSHRAOC3DRD4GAAHTR1A
SCHEMBL20943374 0.86 PSEN1 (0.34) TSHRGAA
SCHEMBL20943373 0.86 PSEN1 (0.34) TSHRGAA
SCHEMBL8115632 0.81 AOC3 (0.52) TSHRAOC3DRD4GAAHTR1A
SCHEMBL8113426 0.81 AOC3 (0.52) TSHRAOC3DRD4GAAHTR1A
SCHEMBL3185372 0.81 AOC3 (0.52) TSHRAOC3DRD4GAAHTR1A
SCHEMBL281883 0.79 IDO1 (0.48)
SCHEMBL282798 0.79 IDO1 (0.48)
SCHEMBL3156406 0.79 IDO1 (0.48)
SCHEMBL20868524 0.78 LMNA (0.50) TSHRAOC3HTR1AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024183772-A1 CYCLIC PHOSPHATE COMPOUND AS DRUG FOR REGULATING CHOLESTEROL METABOLISM VIA LIVER DELIVERY AND USE 浙江柏拉阿图医药科技有限公司 2024-09-12 WO disclosed
EP-3476854-B1 ANTIVIRAL PRECURSOR DRUG NUCLEOSIDE CYCLOPHOSPHATE COMPOUND AND USE THEREOF ZHEJIANG PALOALTO PHARMACEUTICAL TECH CO LTD (CN) 2021-05-12 EP disclosed
CN-107540710-B Liver delivery antiviral prodrug nucleoside cyclic phosphate ester compound and application thereof 浙江柏拉阿图医药科技有限公司 2020-10-16 CN disclosed
US-10668090-B2 Liver specific delivery-based antiviral prodrug nucleoside cyclophosphate compound and uses thereof ZHEJIANG PALO ALTO PHARMACEUTICALS, INC (CN) 2020-06-02 US disclosed
US-20190125771-A1 LIVER SPECIFIC DELIVERY-BASED ANTIVIRAL PRODRUG NUCLEOSIDE CYCLOPHOSPHATE COMPOUND AND USES THEREOF ZHEJIANG PALO ALTO PHARMACEUTICALS,INC (CN) 2019-05-02 US disclosed
EP-3476854-A1 LIVER DELIVERY-BASED ANTIVIRAL PRECURSOR DRUG NUCLEOSIDE CYCLOPHOSPHATE COMPOUND AND USE THEREOF Zhejiang Paloalto Pharmaceutical Technology Co Ltd (CN) 2019-05-01 EP disclosed
EP-1753762-B1 LEWIS ACID MEDIATED SYNTHESIS OF CYCLIC ESTERS METABASIS THERAPEUTICS INC (US) 2014-03-19 EP disclosed
US-7582758-B2 producing cyclic phosphonic acid diesters prodrugs, used to improve the oral bioavailability; by reacting a chiral 1,3-diol and an activated phosphonic acid in the presence of a Lewis acid; Adefovir drug target delivery to liver METABASIS THERAPEUTICS, INC. (US) 2009-09-01 US disclosed
EP-1753762-A1 LEWIS ACID MEDIATED SYNTHESIS OF CYCLIC ESTERS Metabasis Therapeutics, Inc. (US) 2007-02-21 EP disclosed
WO-2005123729-A1 LEWIS ACID MEDIATED SYNTHESIS OF CYCLIC ESTERS METABASIS THERAPEUTICS, INC. (US) 2005-12-29 WO disclosed
US-20050282782-A1 Lewis acid mediated synthesis of cyclic esters CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2005-12-22 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 (3 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-20190125771-A1 LIVER SPECIFIC DELIVERY-BASED ANTIVIRAL PRODRUG NUCLEOSIDE CYCLOPHOSPHATE COMPOUND AND USES THEREOF SLC10A1, NPC1, NPC1L1 TSHR 4759/4885AOC3 2530/4885DRD4 787/4885
US-20050282782-A1 Lewis acid mediated synthesis of cyclic esters PHOSPHO1, LPAR1, LPAR2 TSHR 1594/4885AOC3 1083/4885DRD4 1321/4885
US-10668090-B2 Liver specific delivery-based antiviral prodrug nucleoside cyclophosphate compound and uses thereof SLC10A1, NPC1, NPC1L1 TSHR 4759/4885AOC3 2530/4885DRD4 787/4885

“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.