SCHEMBL18559294

SCHEMBL18559294

CCn1c(SCC(=O)Nc2cccc(NC(C)=O)c2)nnc1C(C)C

nearest known ligand 0.88

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 3/20 0.88
▸ LMNA P02545 3/20 0.84
▸ GLA P06280 2/20 0.64
▸ USP2 O75604 1/20 0.64
▸ ALDH1A1 P00352 4/20 0.62
▸ GAA P10253 1/20 0.62
▸ SMN1; SMN2 Q16637 3/20 0.62
▸ TP53 P04637 1/20 0.62
▸ NPSR1 Q6W5P4 1/20 0.59
▸ HSD17B10 Q99714 1/20 0.59
▸ RECQL P46063 1/20 0.59
▸ NPC1 O15118 1/20 0.57
▸ MAPT P10636 3/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ L3MBTL1 Q9Y468 2/20 0.56
▸ POLB P06746 2/20 0.55

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
SCHEMBL18559209 0.94 TSHR (1.00) TSHRLMNAGLAUSP2ALDH1A1
SCHEMBL18559194 0.92 TSHR (0.81) TSHRLMNAGLAUSP2ALDH1A1
SCHEMBL15986564 0.82 TSHR (0.84) TSHRLMNAGLAUSP2ALDH1A1
SCHEMBL18559039 0.81 TSHR (0.76) TSHRLMNAGLAALDH1A1SMN1; SMN2
SCHEMBL18559212 0.80 L3MBTL1 (0.85) TSHRLMNAGLAALDH1A1GAA
SCHEMBL6405909 0.79 SMN1; SMN2 (0.74) TSHRLMNAGLAALDH1A1SMN1; SMN2
SCHEMBL13832105 0.76 LMNA (0.72) TSHRLMNAALDH1A1GAASMN1; SMN2
SCHEMBL16491233 0.74 SMN1; SMN2 (1.00) TSHRLMNAGLAALDH1A1GAA
SCHEMBL13832139 0.73 MAPK1 (0.66) TSHRLMNAUSP2ALDH1A1GAA
SCHEMBL18559297 0.72 ALDH1A1 (0.82) TSHRLMNAALDH1A1SMN1; SMN2NPSR1

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 TSHR 2971/4885LMNA 4714/4885GLA 4600/4885
US-10813355-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 TSHR 3088/4885LMNA 4708/4885GLA 4672/4885
US-20210219551-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 TSHR 2971/4885LMNA 4714/4885GLA 4600/4885
US-10188105-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 TSHR 2976/4885LMNA 4745/4885GLA 4687/4885
US-20190075798-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 TSHR 3088/4885LMNA 4708/4885GLA 4672/4885

“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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