SCHEMBL18556607

SCHEMBL18556607

CCOC(=O)CN(C(=O)CSc1nnc(COc2ccc(OC)cc2)n1CC)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 1.00
▸ ATM Q13315 1/20 1.00
▸ TSHR P16473 4/20 0.82
▸ SMN1; SMN2 Q16637 2/20 0.62
▸ ALDH1A1 P00352 6/20 0.62
▸ USP2 O75604 1/20 0.62
▸ KMT2A Q03164 1/20 0.62
▸ GAA P10253 1/20 0.58
▸ NPSR1 Q6W5P4 2/20 0.57
▸ LMNA P02545 5/20 0.55
▸ L3MBTL1 Q9Y468 1/20 0.55
▸ TP53 P04637 1/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ CYP3A4 P08684 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ POLB P06746 1/20 0.54
▸ KDM4E B2RXH2 1/20 0.53
▸ MAPK1 P28482 1/20 0.53

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
SCHEMBL4213658 0.79 ALDH1A1 (0.72) MAPTATMTSHRSMN1; SMN2ALDH1A1
SCHEMBL15983716 0.78 MAPT (0.64) MAPTATMTSHRSMN1; SMN2ALDH1A1
SCHEMBL18559144 0.76 ALDH1A1 (1.00) MAPTATMTSHRSMN1; SMN2ALDH1A1
SCHEMBL18559075 0.73 MAPT (1.00) MAPTATMTSHRALDH1A1USP2
SCHEMBL15986415 0.71 TSHR (1.00) MAPTTSHRSMN1; SMN2ALDH1A1USP2
SCHEMBL15986586 0.70 TSHR (1.00) MAPTTSHRSMN1; SMN2ALDH1A1USP2
SCHEMBL14907781 0.69 LMNA (0.69) MAPTTSHRSMN1; SMN2ALDH1A1USP2
SCHEMBL15986587 0.69 MAPT (1.00) MAPTTSHRSMN1; SMN2ALDH1A1USP2
SCHEMBL15983693 0.69 ALDH1A1 (0.60) MAPTATMTSHRSMN1; SMN2ALDH1A1
SCHEMBL15986500 0.68 MAPT (1.00) MAPTTSHRSMN1; SMN2ALDH1A1USP2

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 8 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-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
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 1741/4885ATM 1948/4885TSHR 2971/4885
US-10813355-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 MAPT 2086/4885ATM 1961/4885TSHR 3088/4885
US-20210219551-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 MAPT 1741/4885ATM 1948/4885TSHR 2971/4885
US-10188105-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 MAPT 2002/4885ATM 2056/4885TSHR 2976/4885
US-20190075798-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 MAPT 2086/4885ATM 1961/4885TSHR 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.

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