SCHEMBL18559233

SCHEMBL18559233

CCOC(=O)c1cccc(NC(=O)CSc2nnc(CNc3ccc(C)cc3)n2CC)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 1.00
▸ ALDH1A1 P00352 4/20 1.00
▸ TSHR P16473 3/20 1.00
▸ USP2 O75604 3/20 1.00
▸ ALOX15 P16050 3/20 1.00
▸ SLC27A1 Q6PCB7 4/20 0.78
▸ MAPK1 P28482 3/20 0.71
▸ GAA P10253 1/20 0.71
▸ RECQL P46063 1/20 0.71
▸ PTGES O14684 1/20 0.63
▸ TP53 P04637 1/20 0.60
▸ CASP1 P29466 1/20 0.60
▸ CASP7 P55210 1/20 0.60
▸ HSD17B10 Q99714 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60

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
SCHEMBL15986412 0.85 MAPT (0.74) MAPTALDH1A1TSHRUSP2ALOX15
SCHEMBL18559249 0.83 MAPT (1.00) MAPTALDH1A1TSHRUSP2ALOX15
SCHEMBL15986467 0.78 TSHR (1.00) MAPTALDH1A1TSHRUSP2ALOX15
SCHEMBL18559054 0.78 ALDH1A1 (1.00) MAPTALDH1A1TSHRUSP2ALOX15
SCHEMBL15986597 0.78 ALDH1A1 (1.00) MAPTALDH1A1TSHRUSP2ALOX15
SCHEMBL4197541 0.77 ALDH1A1 (0.78) MAPTALDH1A1TSHRUSP2ALOX15
SCHEMBL18559263 0.77 MAPT (1.00) MAPTALDH1A1TSHRUSP2ALOX15
SCHEMBL18559347 0.75 USP2 (1.00) MAPTALDH1A1TSHRUSP2ALOX15
SCHEMBL15986421 0.75 TSHR (0.89) MAPTALDH1A1TSHRUSP2ALOX15
SCHEMBL18559353 0.75 SMN1; SMN2 (1.00) MAPTALDH1A1TSHRUSP2ALOX15

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 6 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-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-20190075798-A1 Compositions for Inhibition of Insect Sensing VANDERBILT UNIVERSITY 2019-03-14 — — US disclosed
US-10188105-B2 Compositions for inhibition of insect sensing VANDERBILT UNIVERSITY (US) 2019-01-29 — — US disclosed
US-9578881-B2 Compositions for inhibition of insect sensing VANDERBILT UNIVERSITY (US) 2017-02-28 — — 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 (5 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 MAPT 1741/4885ALDH1A1 3579/4885TSHR 2971/4885
US-10813355-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 MAPT 2086/4885ALDH1A1 3568/4885TSHR 3088/4885
US-20210219551-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 MAPT 1741/4885ALDH1A1 3579/4885TSHR 2971/4885
US-10188105-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 MAPT 2002/4885ALDH1A1 3533/4885TSHR 2976/4885
US-20190075798-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 MAPT 2086/4885ALDH1A1 3568/4885TSHR 3088/4885

“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.

Send feedback