SCHEMBL22005702

SCHEMBL22005702

Cc1csc(C(=O)OCc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.51
SLC6A2 P23975 1/20 0.51
SLC6A3 Q01959 1/20 0.51
KMT2A Q03164 1/20 0.51
DAO P14920 1/20 0.50
MMP12 P39900 1/20 0.49
ALDH1A1 P00352 6/20 0.49
LMNA P02545 1/20 0.47
MAPT P10636 3/20 0.46
HPGD P15428 1/20 0.46
RAB9A P51151 5/20 0.45
TSHR P16473 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPK1 P28482 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
CYP3A4 P08684 1/20 0.44
STAT1 P42224 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
POLB P06746 1/20 0.44
ATM Q13315 1/20 0.44

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
SCHEMBL29138189 0.83 TDP1 (0.53) TDP1SLC6A2SLC6A3KMT2ADAO
SCHEMBL27580288 0.82 TDP1 (0.49) TDP1SLC6A2SLC6A3KMT2AMMP12
SCHEMBL20415475 0.81 TDP1 (0.47) TDP1SLC6A2SLC6A3KMT2AMMP12
SCHEMBL6826976 0.79 DAO (0.57) TDP1KMT2ADAOALDH1A1MAPT
SCHEMBL7085790 0.76 DAO (0.55) TDP1KMT2ADAOLMNAMAPT
SCHEMBL22005700 0.76 TDP1 (0.60) TDP1SLC6A2SLC6A3KMT2ADAO
SCHEMBL29138182 0.75 LIPG (0.41) TDP1SLC6A2SLC6A3KMT2AMMP12
SCHEMBL8545579 0.75 TDP1 (0.63) TDP1SLC6A2SLC6A3KMT2AMMP12
SCHEMBL15987451 0.75 KMT2A (0.54) TDP1SLC6A2SLC6A3KMT2ADAO
SCHEMBL22005552 0.75 TDP1 (0.50) TDP1SLC6A2SLC6A3KMT2AALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230355590-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE NISSAN CHEMICAL CORPORATION (JP) 2023-11-09 US disclosed
US-20230355590-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE NISSAN CHEMICAL CORPORATION (JP) 2023-11-09 US disclosed
US-10874645-B2 Isoxazoline-substituted benzamide compound and pesticide NISSAN CHEMICAL CORPORATION (JP) 2020-12-29 US disclosed
US-20200155511-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE NISSAN CHEMICAL CORPORATION (JP) 2020-05-21 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 (3 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-20230355590-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE HDAC7, ACHE, BRDT TDP1 3193/4885SLC6A2 633/4885SLC6A3 374/4885
US-10874645-B2 Isoxazoline-substituted benzamide compound and pesticide C3AR1, C5, C9 TDP1 4037/4885SLC6A2 1623/4885SLC6A3 748/4885
US-20200155511-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE C3AR1, C5, C9 TDP1 4037/4885SLC6A2 1623/4885SLC6A3 748/4885

“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.