SCHEMBL13831900

SCHEMBL13831900

CC(C)c1ccc(SC(F)F)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.60
MAPT P10636 7/20 0.60
LMNA P02545 7/20 0.60
ALDH1A1 P00352 5/20 0.60
PKM P14618 1/20 0.60
TYR P14679 2/20 0.38
KMT2A Q03164 7/20 0.37
MEN1 O00255 5/20 0.37
HTT P42858 6/20 0.37
ALPL P05186 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
BCL2 P10415 1/20 0.36
MCL1 Q07820 1/20 0.36
DDB1 Q16531 1/20 0.35
CRBN Q96SW2 1/20 0.35
GAA P10253 2/20 0.35
KDM4E B2RXH2 1/20 0.35
THRB P10828 1/20 0.35

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
SCHEMBL9836847 0.82 ADRB2 (0.46) SMN1; SMN2MAPTLMNAALDH1A1PKM
SCHEMBL12356893 0.80 LMNA (0.42) SMN1; SMN2MAPTLMNAALDH1A1PKM
SCHEMBL11444427 0.76 SMN1; SMN2 (0.40) SMN1; SMN2MAPTLMNAALDH1A1PKM
SCHEMBL2321466 0.75 LMNA (0.47) SMN1; SMN2MAPTLMNAALDH1A1PKM
SCHEMBL2286241 0.75 MAPK1 (0.50) SMN1; SMN2MAPTLMNAALDH1A1PKM
SCHEMBL18873296 0.75 TYR (0.41) SMN1; SMN2MAPTLMNAALDH1A1PKM
SCHEMBL14309168 0.74 PTPN5 (0.42) SMN1; SMN2MAPTLMNAALDH1A1PKM
SCHEMBL11158360 0.74 ESR1 (0.41) SMN1; SMN2MAPTLMNAALDH1A1PKM
SCHEMBL14199938 0.74 ALDH1A1 (0.40) SMN1; SMN2MAPTLMNAALDH1A1PKM
SCHEMBL2279013 0.74 MCL1 (0.53) LMNAALDH1A1TYRKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230136150-A1 Compositions for Inhibition of Insect Sensing UNIV VANDERBILT (US) 2023-05-04 US disclosed
US-20230136150-A1 Compositions for Inhibition of Insect Sensing UNIV VANDERBILT (US) 2023-05-04 US disclosed
US-20210219551-A1 Compositions for Inhibition of Insect Sensing VANDERBILT UNIVERSITY 2021-07-22 US disclosed
US-10813355-B2 Compositions for inhibition of insect sensing VANDERBILT UNIVERSITY (US) 2020-10-27 US disclosed
US-10188105-B2 Compositions for inhibition of insect sensing VANDERBILT UNIVERSITY (US) 2019-01-29 US disclosed
US-20170208809-A1 Compositions for Inhibition of Insect Sensing VANDERBILT UNIVERSITY 2017-07-27 US disclosed
US-20170208809-A1 Compositions for Inhibition of Insect Sensing VANDERBILT UNIVERSITY 2017-07-27 US disclosed
US-9578881-B2 Compositions for inhibition of insect sensing VANDERBILT UNIVERSITY (US) 2017-02-28 US disclosed
US-20140242135-A1 COMPOSITIONS FOR INHIBITION OF INSECT SENSING VANDERBILT UNIVERSITY (US) 2014-08-28 US disclosed
US-8778874-B2 Glycopeptide antibiotic monomer derivatives NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2014-07-15 US disclosed
WO-2012154403-A9 COMPOSITIONS FOR INHIBITION OF INSECT SENSING VANDERBILT UNIVERSITY (US) 2013-01-03 WO disclosed
WO-2012154403-A2 COMPOSITION FOR INHIBITION OF INSECT SENSING VANDERBILT UNIVERSITY (US) 2012-11-15 WO disclosed
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria SHIONOGI & CO., LTD. (JP) 2008-04-24 US disclosed
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria SHIONOGI & CO., LTD. (JP) 2008-04-24 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 (7 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-20230136150-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 SMN1; SMN2 4423/4885MAPT 1741/4885LMNA 4714/4885
US-10813355-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 SMN1; SMN2 4355/4885MAPT 2086/4885LMNA 4708/4885
US-20140242135-A1 COMPOSITIONS FOR INHIBITION OF INSECT SENSING OR51E2, TRPA1, OR10J3 SMN1; SMN2 4493/4885MAPT 1681/4885LMNA 4737/4885
US-20210219551-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 SMN1; SMN2 4423/4885MAPT 1741/4885LMNA 4714/4885
US-10188105-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 SMN1; SMN2 4404/4885MAPT 2002/4885LMNA 4745/4885
US-20170208809-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 SMN1; SMN2 4404/4885MAPT 2002/4885LMNA 4745/4885
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria CSGALNACT1, MON2, NR2C2 SMN1; SMN2 3927/4885MAPT 4669/4885LMNA 4466/4885

“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.