SCHEMBL18558964

SCHEMBL18558964

CCn1c(SCC(=O)Nc2cc(NC(C)=O)ccc2OC)nnc1-c1cccnc1

nearest known ligand 0.82

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 0.81
▸ ALDH1A1 P00352 2/20 0.63
▸ USP2 O75604 2/20 0.63
▸ KMT2A Q03164 1/20 0.63
▸ MAPK1 P28482 1/20 0.61
▸ LMNA P02545 1/20 0.57
▸ HTT P42858 1/20 0.57
▸ MAPT P10636 1/20 0.57

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
SCHEMBL18559132 0.91 ALDH1A1 (0.67) SMN1; SMN2ALDH1A1USP2KMT2AMAPK1
SCHEMBL18559051 0.90 MAPT (0.71) SMN1; SMN2ALDH1A1KMT2AHTTMAPT
SCHEMBL18559141 0.90 SMN1; SMN2 (1.00) SMN1; SMN2ALDH1A1KMT2ALMNAHTT
SCHEMBL18559300 0.84 SMN1; SMN2 (0.75) SMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL18559204 0.83 KMT2A (0.68) SMN1; SMN2ALDH1A1USP2KMT2AMAPK1
SCHEMBL13831690 0.83 USP2 (0.64) SMN1; SMN2ALDH1A1USP2KMT2AMAPK1
SCHEMBL13737637 0.81 KMT2A (0.75) ALDH1A1USP2KMT2AMAPK1LMNA
SCHEMBL13831729 0.80 ALDH1A1 (0.69) ALDH1A1USP2KMT2AMAPK1LMNA
SCHEMBL13739253 0.80 ALDH1A1 (0.74) SMN1; SMN2ALDH1A1USP2KMT2AMAPK1
SCHEMBL13831736 0.79 ALDH1A1 (0.80) ALDH1A1USP2KMT2AMAPK1LMNA

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 SMN1; SMN2 4423/4885ALDH1A1 3579/4885USP2 2348/4885
US-10813355-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 SMN1; SMN2 4355/4885ALDH1A1 3568/4885USP2 2256/4885
US-20210219551-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 SMN1; SMN2 4423/4885ALDH1A1 3579/4885USP2 2348/4885
US-10188105-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 SMN1; SMN2 4404/4885ALDH1A1 3533/4885USP2 2329/4885
US-20190075798-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 SMN1; SMN2 4355/4885ALDH1A1 3568/4885USP2 2256/4885

“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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