SCHEMBL5821

SCHEMBL5821

Nc1ccn([C@H]2C=C[C@@H](CO)O2)c(=O)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.55
THRB P10828 1/20 0.55
MTOR P42345 1/20 0.55
MDM2 Q00987 1/20 0.55
NCOA1 Q15788 1/20 0.55
NCOA3 Q9Y6Q9 1/20 0.55
PDE3A Q14432 3/20 0.53
ALB P02768 3/20 0.53
CACNA1F O60840 2/20 0.53
MAPT P10636 2/20 0.53
CACNA1D Q01668 2/20 0.53
CACNA1S Q13698 2/20 0.53
CACNA1C Q13936 2/20 0.53
PDE4D Q08499 1/20 0.52
SLC29A1 Q99808 1/20 0.52
POLB P06746 2/20 0.45
ALDH1A1 P00352 1/20 0.45
ADRA1A P35348 1/20 0.45
BLM P54132 1/20 0.45
NT5E P21589 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
SCHEMBL7154210 1.00 LMNA (0.55) LMNATHRBMTORMDM2NCOA1
SCHEMBL1980249 1.00 LMNA (0.55) LMNATHRBMTORMDM2NCOA1
SCHEMBL14580321 1.00 LMNA (0.55) LMNATHRBMTORMDM2NCOA1
SCHEMBL31662024 0.87 LMNA (0.47) LMNATHRBMTORMDM2NCOA1
SCHEMBL8644096 0.84 LMNA (0.45) LMNATHRBMTORMDM2NCOA1
SCHEMBL1739891 0.81 POLG (0.48) LMNATHRBMTORMDM2NCOA1
SCHEMBL4285392 0.81 LMNA (0.43) LMNATHRBMTORMDM2NCOA1
SCHEMBL10510561 0.80 HRAS (0.44) LMNATHRBMTORMDM2NCOA1
SCHEMBL10512002 0.80 DUT (0.42) LMNATHRBMTORMDM2NCOA1
SCHEMBL10512094 0.78 NLRP3 (0.44) LMNATHRBMTORMDM2NCOA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116536308-A Sequencing sealant and application thereof 深圳吉因加医学检验实验室 2023-08-04 CN claimed
US-9198893-B2 Combination antitumor therapy GALERA LABS, LLC (US) 2015-12-01 US claimed
US-20150150893-A1 ANDROGRAPHOLIDE ANALOGS AND THEIR USE FOR MEDICATION LIAONING LIFENG SCIENT & TECHNOLOGY DEV COMPANY LTD (CN) 2015-06-04 US claimed
US-8124613-B2 Spirotropane compounds VIROCHEM PHARMA INC. (CA) 2012-02-28 US claimed
US-20110136756-A1 COMBINATION ANTITUMOR THERAPY BIOSSIL INC. (CA) 2011-06-09 US claimed
US-20110105546-A1 SPIROTROPANE COMPOUNDS VIROCHEM PHARMA INC. (CA) 2011-05-05 US claimed
EP-2296645-A2 COMBINATION ANTITUMOR THERAPY Kereos, Inc. (US) 2011-03-23 EP claimed
EP-2257567-A1 NOVEL 17 BETA LUPANE DERIVATIVES Virochem Pharma Inc. (CA) 2010-12-08 EP claimed
WO-2009143454-A2 COMBINATION ANTITUMOR THERAPY KEREOS, INC. (US) 2009-11-26 WO claimed
WO-2009100532-A1 NOVEL 17ß LUPANE DERIVATIVES VIROCHEM PHARMA INC. (CA) 2009-08-20 WO claimed
EP-0261595-B1 PHARMACEUTICAL COMPOSITION COMPRISING 2',3'-DIDEOXYCYTIDIN-2'-ENE(2',3'-DIDEHYDROCYTIDINE) FOR TREATING PATIENTS INFECTED WITH RETROVIRUS YALE UNIVERSITY (US) 1992-09-02 EP claimed
US-5116822-A Therapeutic application of dideoxycytidinene STICHTING REGA VZW (BE) 1992-05-26 US claimed
US-5109016-A Method for inhibiting infection or replication of human immunodeficiency virus with porphyrin and phthalocyanine antiviral compositions GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) 1992-04-28 US claimed
US-5077280-A Coadministering pyrimidine nucleoside and phosphorylase inhibitor to reduce toxicity of nuceloside BROWN UNIVERSITY RESEARCH FOUNDATION (US) 1991-12-31 US claimed
WO-1991000867-A1 5'-DIPHOSPHOHEXOSE NUCLEOSIDE PHARMACEUTICAL COMPOSITIONS UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 1991-01-24 WO claimed
US-4963533-A TREATMENT OF AIDS AND AIDS RELATED DISEASES STICHTING REGA VZW (REGA) (BE) 1990-10-16 US claimed
WO-1989011277-A2 PORPHYRIN AND PHTHALOCYANINE ANTIVIRAL COMPOSITIONS GEORGIA STATE UNIVERSITY FOUNDATION, INC. (US) 1989-11-30 WO claimed
EP-0342422-A2 Process for the preparation of 2',3'-dideoxynucleosides, and intermediates used therein F. HOFFMANN-LA ROCHE AG (CH) 1989-11-23 EP claimed
WO-1989009603-A1 TREATMENT OF VIRAL INFECTIONS BROWN UNIVERSITY RESEARCH FOUNDATION (US) 1989-10-19 WO claimed
EP-0311100-A2 Derivatives of dideoxycytidine, their preparation and pharmaceutical use F. HOFFMANN-LA ROCHE AG (CH) 1989-04-12 EP 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 (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-20150150893-A1 ANDROGRAPHOLIDE ANALOGS AND THEIR USE FOR MEDICATION CYP11B1, CYP51A1, CYP11B2 LMNA 2583/4885THRB 3962/4885MTOR 2878/4885
US-20110136756-A1 COMBINATION ANTITUMOR THERAPY SOD3, SOD1, MCL1 LMNA 3699/4885THRB 4054/4885MTOR 3542/4885
US-20110105546-A1 SPIROTROPANE COMPOUNDS CCR5, CXCR1, CXCR2 LMNA 2735/4885THRB 375/4885MTOR 4435/4885

“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.