SCHEMBL18559373

SCHEMBL18559373

CCn1c(CSc2nc(C)cc(C)n2)nnc1SCC(=O)Nc1cccc2ccccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 1/20 1.00
▸ USP2 O75604 3/20 0.75
▸ TSHR P16473 3/20 0.64
▸ MAPT P10636 1/20 0.64
▸ KMT2A Q03164 1/20 0.64
▸ POLB P06746 1/20 0.62
▸ CYP3A4 P08684 1/20 0.59
▸ RORC P51449 1/20 0.59
▸ HTT P42858 1/20 0.57
▸ ANXA2 P07355 11/20 0.57
▸ S100A10 P60903 11/20 0.57
▸ ALDH1A1 P00352 1/20 0.57
▸ TP53 P04637 1/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ SIRT2 Q8IXJ6 1/20 0.52

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
SCHEMBL18559076 0.86 USP2 (1.00) SMN1; SMN2USP2TSHRMAPTKMT2A
SCHEMBL13832073 0.80 MEN1 (0.69) SMN1; SMN2USP2TSHRKMT2ACYP3A4
SCHEMBL14732159 0.78 SMN1; SMN2 (0.67) SMN1; SMN2USP2TSHRMAPTKMT2A
SCHEMBL14732174 0.78 SMN1; SMN2 (0.63) SMN1; SMN2USP2TSHRMAPTKMT2A
SCHEMBL14732156 0.78 SMN1; SMN2 (0.63) SMN1; SMN2TSHRMAPTKMT2ACYP3A4
SCHEMBL13831958 0.77 CYP3A4 (0.65) SMN1; SMN2USP2TSHRKMT2ACYP3A4
SCHEMBL13831273 0.77 NPSR1 (0.69) SMN1; SMN2USP2TSHRMAPTKMT2A
SCHEMBL15983381 0.77 SMN1; SMN2 (0.62) SMN1; SMN2USP2TSHRMAPTKMT2A
SCHEMBL15983303 0.77 ALDH1A1 (0.66) SMN1; SMN2USP2TSHRMAPTPOLB
SCHEMBL14732106 0.76 SMN1; SMN2 (0.61) SMN1; SMN2USP2TSHRMAPTKMT2A

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 4423/4885USP2 2348/4885TSHR 2971/4885
US-10813355-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 SMN1; SMN2 4355/4885USP2 2256/4885TSHR 3088/4885
US-20210219551-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 SMN1; SMN2 4423/4885USP2 2348/4885TSHR 2971/4885
US-10188105-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 SMN1; SMN2 4404/4885USP2 2329/4885TSHR 2976/4885
US-20190075798-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 SMN1; SMN2 4355/4885USP2 2256/4885TSHR 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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