SCHEMBL18559287

SCHEMBL18559287

CCn1c(SCC(=O)Nc2ccc(NC(=O)c3ccco3)cc2)nnc1-c1cccs1

nearest known ligand 0.89

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.89
▸ ALDH1A1 P00352 6/20 0.89
▸ HSD17B10 Q99714 4/20 0.89
▸ USP2 O75604 3/20 0.89
▸ NPSR1 Q6W5P4 2/20 0.69
▸ POLB P06746 5/20 0.68
▸ KDM4E B2RXH2 3/20 0.68
▸ RXFP1 Q9HBX9 1/20 0.68
▸ TDP1 Q9NUW8 2/20 0.66
▸ HTT P42858 2/20 0.66
▸ HPGD P15428 2/20 0.66
▸ PKM P14618 1/20 0.66
▸ APEX1 P27695 1/20 0.66
▸ RAB9A P51151 1/20 0.66
▸ CYP3A4 P08684 1/20 0.62
▸ CYP2C9 P11712 1/20 0.62
▸ CYP2C19 P33261 1/20 0.62
▸ ATM Q13315 1/20 0.62
▸ LMNA P02545 2/20 0.62
▸ L3MBTL1 Q9Y468 1/20 0.62

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
SCHEMBL18559372 0.94 MAPT (1.00) MAPTALDH1A1HSD17B10USP2NPSR1
SCHEMBL18559074 0.86 ALDH1A1 (1.00) MAPTALDH1A1HSD17B10USP2NPSR1
SCHEMBL13832070 0.85 ALDH1A1 (0.83) MAPTALDH1A1HSD17B10USP2NPSR1
SCHEMBL22046603 0.83 MAPT (0.79) MAPTALDH1A1HSD17B10USP2NPSR1
SCHEMBL3889633 0.83 MAPT (0.82) MAPTALDH1A1HSD17B10USP2NPSR1
SCHEMBL15986443 0.83 ALDH1A1 (0.80) MAPTALDH1A1HSD17B10USP2NPSR1
SCHEMBL15983290 0.83 MAPT (0.82) MAPTALDH1A1HSD17B10USP2NPSR1
SCHEMBL15983276 0.82 ALDH1A1 (0.79) MAPTALDH1A1HSD17B10USP2NPSR1
SCHEMBL18559153 0.81 MAPT (1.00) MAPTALDH1A1HSD17B10USP2NPSR1
SCHEMBL15983294 0.81 ALDH1A1 (0.77) MAPTALDH1A1HSD17B10USP2NPSR1

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 3579/4885HSD17B10 4582/4885
US-10813355-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 MAPT 2086/4885ALDH1A1 3568/4885HSD17B10 4549/4885
US-20210219551-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 MAPT 1741/4885ALDH1A1 3579/4885HSD17B10 4582/4885
US-10188105-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 MAPT 2002/4885ALDH1A1 3533/4885HSD17B10 4480/4885
US-20190075798-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 MAPT 2086/4885ALDH1A1 3568/4885HSD17B10 4549/4885

“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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