SCHEMBL20201219

SCHEMBL20201219

Cc1cnccc1C(=O)OCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.58
KMT2A Q03164 2/20 0.58
LMNA P02545 2/20 0.58
ALDH1A1 P00352 5/20 0.54
POLB P06746 2/20 0.52
L3MBTL1 Q9Y468 4/20 0.52
TSHR P16473 2/20 0.52
RAB9A P51151 2/20 0.52
CASP3 P42574 1/20 0.52
SENP8 Q96LD8 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
SENP6 Q9GZR1 1/20 0.52
SLC6A2 P23975 1/20 0.50
SLC6A3 Q01959 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPK1 P28482 1/20 0.50
HPGD P15428 2/20 0.49
NPSR1 Q6W5P4 1/20 0.49
EGLN1 Q9GZT9 1/20 0.47
GCGR P47871 1/20 0.46

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
SCHEMBL8124275 0.88 TDP1 (0.58) TDP1KMT2ALMNAALDH1A1POLB
SCHEMBL29286546 0.86 TDP1 (0.63) TDP1KMT2ALMNAALDH1A1POLB
SCHEMBL22258325 0.84 TDP1 (0.60) TDP1KMT2ALMNAALDH1A1POLB
SCHEMBL28554760 0.82 TDP1 (0.58) TDP1KMT2ALMNAALDH1A1POLB
SCHEMBL20201217 0.82 ALDH1A1 (0.57) TDP1KMT2ALMNAALDH1A1POLB
SCHEMBL277304 0.81 TSHR (0.53) TDP1KMT2AALDH1A1TSHRMAPT
SCHEMBL29353285 0.81 ALDH1A1 (0.69) TDP1KMT2ALMNAALDH1A1POLB
SCHEMBL2705753 0.81 ALDH1A1 (0.69) TDP1KMT2ALMNAALDH1A1POLB
SCHEMBL25541338 0.80 TDP1 (0.55) TDP1KMT2ALMNAALDH1A1POLB
Hydrochloric Acid SCHEMBL11490589 0.80 KMT2A (0.56) TDP1KMT2ALMNAALDH1A1POLB

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 7 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-20230339982-A1 CHEMICAL COMPOUND, USE OF AT LEAST ONE SUCH CHEMICAL COMPOUND IN AN OPTOELECTRONIC COMPONENT, AND OPTOELECTRONIC COMPONENT CONTAINING AT LEAST ONE SUCH CHEMICAL COMPOUND TECHNISCHE UNIVERSITAET DRESDEN (DE) 2023-10-26 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
US-10005768-B2 Carboxamide derivatives and use thereof PURDUE PHARMA L.P. (US) 2018-06-26 US disclosed
US-20180148414-A1 PHOTOREDOX-CATALYZED DIRECT C-H FUNCTIONALIZATION OF ARENES THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2018-05-31 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 (6 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 3193/4885KMT2A 342/4885LMNA 2363/4885
US-10005768-B2 Carboxamide derivatives and use thereof TRPV1, CACNA1A, SCN10A TDP1 3889/4885KMT2A 1142/4885LMNA 2073/4885
US-20230339982-A1 CHEMICAL COMPOUND, USE OF AT LEAST ONE SUCH CHEMICAL COMPOUND IN AN OPTOELECTRONIC COMPONENT, AND OPTOELECTRONIC COMPONENT CONTAINING AT LEAST ONE SUCH CHEMICAL COMPOUND OSTC, OR51E2, ALDH1A2 TDP1 4765/4885KMT2A 3044/4885LMNA 4691/4885
US-10874645-B2 Isoxazoline-substituted benzamide compound and pesticide C3AR1, C5, C9 TDP1 4037/4885KMT2A 2752/4885LMNA 1078/4885
US-20180148414-A1 PHOTOREDOX-CATALYZED DIRECT C-H FUNCTIONALIZATION OF ARENES PPOX, AOC2, AOC3 TDP1 2574/4885KMT2A 1406/4885LMNA 3847/4885
US-20200155511-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE C3AR1, C5, C9 TDP1 4037/4885KMT2A 2752/4885LMNA 1078/4885

“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.