SCHEMBL98311

SCHEMBL98311

O=[C]COc1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
MEN1 O00255 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
KCNH2 Q12809 2/20 0.46
SOD1 P00441 1/20 0.46
KDM4E B2RXH2 3/20 0.44
CYP1A2 P05177 1/20 0.43
DAO P14920 1/20 0.43
GRM5 P41594 1/20 0.42
MAOB P27338 2/20 0.42
APP P05067 1/20 0.42
GPR84 Q9NQS5 1/20 0.42
NR4A2 P43354 1/20 0.42
ALDH3A1 P30838 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
TDP1 Q9NUW8 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
SCHEMBL8897520 0.94 MAOA (0.47) ALDH1A1MEN1RAB9AKMT2AKCNH2
SCHEMBL2170360 0.88 CA12 (0.42) ALDH1A1MEN1RAB9AKMT2AKDM4E
SCHEMBL5536815 0.78 ALDH3A1 (0.47) MEN1RAB9AKMT2AKCNH2SOD1
SCHEMBL2511132 0.77 CA12 (0.53) ALDH1A1MEN1RAB9AKMT2AKCNH2
SCHEMBL187687 0.77 ALDH3A1 (0.50) ALDH1A1MEN1RAB9AKMT2AKCNH2
SCHEMBL6213159 0.77 SOD1 (0.47) ALDH1A1SOD1GRM5L3MBTL1TDP1
SCHEMBL10404569 0.77 KCNH2 (0.46) ALDH1A1MEN1RAB9AKMT2AKCNH2
SCHEMBL99544 0.77 DAO (0.43) RAB9ACYP1A2DAOMAOBAPP
SCHEMBL514644 0.77 L3MBTL1 (0.47) KCNH2GRM5MAOBL3MBTL1
SCHEMBL6978990 0.77 TDP1 (0.52) ALDH1A1RAB9AMAOBAPPL3MBTL1

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 500 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210206809-A1 PEPTIDE NUCLEIC ACID (PNA) MONOMERS WITH AN ORTHOGONALLY PROTECTED ESTER MOIETY VERA THERAPEUTICS INC (US) 2021-07-08 US claimed
EP-3601237-A2 PEPTIDE NUCLEIC ACID (PNA) MONOMERS WITH AN ORTHOGONALLY PROTECTED ESTER MOIETY Trucode Gene Repair, Inc. (US) 2020-02-05 EP claimed
CN-110740994-A Peptide Nucleic Acid (PNA) monomers with orthogonally protected ester moieties 特鲁科德基因修复公司 2020-01-31 CN claimed
CN-105777640-B Pyrazole cyclohexanediol ether compound and application thereof 沈阳中化农药化工研发有限公司 2020-01-07 CN claimed
WO-2018175927-A2 PEPTIDE NUCLEIC ACID (PNA) MONOMERS WITH AN ORTHOGONALLY PROTECTED ESTER MOIETY TRUCODE GENE REPAIR, INC. (US) 2018-09-27 WO claimed
CN-104017001-B A kind of method of chemosynthesis mosictin DALIAN JOIN KING BIOLOGICAL CHEMICAL TECHNOLOGY CO., LTD. (CN) 2016-01-13 CN claimed
EP-1512397-B1 O-SUBSTITUTED HYDROXYARYL DERIVATIVES INST MED MOLECULAR DESIGN INC (JP) 2014-10-08 EP claimed
CN-104017001-A Method of chemically synthesizing moxidectin DALIAN JOIN KING BIOCHEM TECH CO LTD 2014-09-03 CN claimed
EP-2248820-B1 Universal supports for oligonucleotide synthesis GLEN RES CORP (US) 2014-01-08 EP claimed
EP-1506176-B1 AMINOINDAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PFIZER ITALIA SRL (IT) 2013-04-24 EP claimed
US-4785010-A AGING RESISTANCE OF HUMANS CASSELLA AKTIENGESELLSCHAFT (DE) 1988-11-15 US claimed
EP-0124067-B1 2-(AMINOALKYL)-PYRROLE DERIVATIVES, PROCESS FOR THEIR MANUFACTURE AND THEIR USE CASSELLA Aktiengesellschaft (DE) 1986-12-17 EP claimed
EP-0090203-B1 PROCESS FOR PREPARING P.CHLOROPHENOXYACETYL-PIPERONYLPIPERAZINE RAVIZZA S.p.A. (IT) 1986-11-12 EP claimed
EP-0081425-B1 PHARMACEUTICAL COMPOSITIONS HAVING NORMOLIPEMIC PROPERTIES AND CONTAINING COMPOUNDS OF THE N-SUBSTITUTED BENZENESULFONAMIDE TYPE CHOAY S.A. (FR) 1985-09-18 EP claimed
EP-0124067-A1 2-(Aminoalkyl)-pyrrole derivatives, process for their manufacture and their use CASSELLA Aktiengesellschaft (DE) 1984-11-07 EP claimed
US-4178445-A 7-(α-Substituted glycinamido)-3-substituted methyl-3-cephem-4-carboxylic acids and their derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1979-12-11 US claimed
US-4072703-A HUMAN AND VETERINARY MEDICINE CHIMIE & BIOLOGIE (FR) 1978-02-07 US claimed
US-4006163-A POLYESTERS CIBA-GEIGY CORPORATION (US) 1977-02-01 US claimed
US-3975532-A ANALGESIC ICI UNITED STATES INC. (US) 1976-08-17 US claimed
US-3972774-A BY AN ESTERASE ENZYME FROM BACILLUS ELI LILLY AND COMPANY (US) 1976-08-03 US claimed

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-20210206809-A1 PEPTIDE NUCLEIC ACID (PNA) MONOMERS WITH AN ORTHOGONALLY PROTECTED ESTER MOIETY AGO2, TARBP1, TPR ALDH1A1 4394/4885MEN1 2159/4885RAB9A 4005/4885

“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.