SCHEMBL18559232

SCHEMBL18559232

COc1cc(Cl)c(C)cc1NC(=O)CSc1nnc(-c2cccnc2)n1Cc1ccco1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 5/20 0.79
OPRK1 P41145 1/20 0.75
ALDH1A1 P00352 6/20 0.65
MAPT P10636 5/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
LMNA P02545 4/20 0.62
GAA P10253 2/20 0.62
NPSR1 Q6W5P4 2/20 0.62
HSD17B10 Q99714 2/20 0.62
HPGD P15428 1/20 0.62
ALOX15 P16050 1/20 0.62
TSHR P16473 6/20 0.62
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
KDM4E B2RXH2 1/20 0.62
ALOX12 P18054 1/20 0.62
ATM Q13315 2/20 0.61
POLB P06746 1/20 0.61
TDP1 Q9NUW8 1/20 0.59

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
SCHEMBL18559224 0.88 USP2 (1.00) USP2ALDH1A1MAPTLMNAGAA
SCHEMBL18556570 0.83 ALDH1A1 (0.71) USP2OPRK1ALDH1A1MAPTLMNA
SCHEMBL15983722 0.79 USP2 (0.65) USP2ALDH1A1MAPTLMNANPSR1
SCHEMBL18559280 0.79 MAPT (1.00) OPRK1ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL18559066 0.77 USP2 (1.00) USP2ALDH1A1MAPTSMN1; SMN2LMNA
SCHEMBL18556566 0.76 ALDH1A1 (0.80) USP2ALDH1A1MAPTLMNANPSR1
SCHEMBL4148366 0.76 ALDH1A1 (1.00) USP2ALDH1A1MAPTLMNANPSR1
SCHEMBL18556565 0.75 ALDH1A1 (0.84) USP2OPRK1ALDH1A1MAPTLMNA
SCHEMBL4208503 0.75 TSHR (0.74) USP2OPRK1ALDH1A1MAPTLMNA
SCHEMBL4206151 0.75 TSHR (0.74) USP2OPRK1ALDH1A1MAPTLMNA

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 USP2 2348/4885OPRK1 167/4885ALDH1A1 3579/4885
US-10813355-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 USP2 2256/4885OPRK1 150/4885ALDH1A1 3568/4885
US-20210219551-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 USP2 2348/4885OPRK1 167/4885ALDH1A1 3579/4885
US-10188105-B2 Compositions for inhibition of insect sensing OR51E2, TRPA1, OR10J3 USP2 2329/4885OPRK1 156/4885ALDH1A1 3533/4885
US-20190075798-A1 Compositions for Inhibition of Insect Sensing OR51E2, TRPA1, OR10J3 USP2 2256/4885OPRK1 150/4885ALDH1A1 3568/4885

“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.