SCHEMBL462356

SCHEMBL462356

CCCCCC(=O)C1CCc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PIN1 Q13526 4/20 0.48
MTNR1A P48039 4/20 0.42
MTNR1B P49286 4/20 0.42
SIGMAR1 Q99720 4/20 0.41
HTT P42858 1/20 0.41
HTR2C P28335 1/20 0.41
SLC6A3 Q01959 1/20 0.41
DRD2 P14416 1/20 0.40
ABL1 P00519 1/20 0.40
RIN1 Q13671 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KCNQ2 O43526 1/20 0.40

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
SCHEMBL7696586 0.92 HTT (0.48) SIGMAR1HTTALDH1A1
SCHEMBL30191225 0.83 PIN1 (0.54) PIN1MTNR1AMTNR1BHTTDRD2
SCHEMBL11305795 0.83 PIN1 (0.54) PIN1MTNR1AMTNR1BHTTDRD2
SCHEMBL599522 0.81 GAA (0.47) MTNR1AMTNR1BALDH1A1
SCHEMBL29458278 0.81 GAA (0.47) MTNR1AMTNR1BALDH1A1
SCHEMBL608005 0.81 GAA (0.47) MTNR1AMTNR1BALDH1A1
SCHEMBL30721195 0.81 GAA (0.47) MTNR1AMTNR1BALDH1A1
SCHEMBL11666042 0.80 PIN1 (0.51) PIN1MTNR1AMTNR1BHTR2CSLC6A3
SCHEMBL11354503 0.77 HTR2C (0.45) HTR2CSLC6A3ABL1RIN1ALDH1A1
SCHEMBL30420872 0.77 PIN1 (0.46) PIN1MTNR1AMTNR1BSIGMAR1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150037891-A1 METHODS FOR ENHANCING INFECTIVITY OF RETROVIRUSES SAPHIRE ANDREW (US) 2015-02-05 US disclosed
US-8802439-B2 Methods for enhancing infectivity of retroviruses NATIONAL INSTITUTES OF HEALTH 2014-08-12 US disclosed
EP-2733213-A1 Kit for producing a retrovirus with enhanced infectivity Saphire, Andrew C. (US) 2014-05-21 EP disclosed
EP-2432885-B1 METHODS FOR ENHANCING INFECTIVITY OF RETROVIRUSES SAPHIRE ANDREW C (US) 2014-01-22 EP disclosed
EP-2432885-A2 METHODS FOR ENHANCING INFECTIVITY OF RETROVIRUSES The Scripps Research Institute (US) 2012-03-28 EP disclosed
US-20120064604-A1 METHODS FOR ENHANCING INFECTIVITY OF RETROVIRUSES NATIONAL INSTITUTES OF HEALTH 2012-03-15 US disclosed
WO-2010134975-A2 METHODS FOR ENHANCING INFECTIVITY OF RETROVIRUSES THE SCRIPPS RESEARCH INSTITUTE (US) 2010-11-25 WO disclosed
US-7786090-B2 Methods and compositions for treating and preventing neurologic disorders PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-08-31 US disclosed
US-20070282017-A1 Methods and compositions for treating and preventing neurologic disorders NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2007-12-06 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-20070282017-A1 Methods and compositions for treating and preventing neurologic disorders ACHE, NLN, AQP4 PIN1 1865/4885MTNR1A 258/4885MTNR1B 378/4885

“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.