SCHEMBL6112936

SCHEMBL6112936

CCOC(=O)c1cccc2nc(Cl)sc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
CYP1A2 P05177 1/20 0.46
CDC25B P30305 2/20 0.45
ALDH1A1 P00352 4/20 0.44
HSD17B10 Q99714 2/20 0.44
KDM4E B2RXH2 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
ILK Q13418 1/20 0.42
MAPT P10636 2/20 0.42
GAA P10253 2/20 0.42
CDC25A P30304 1/20 0.42
CDC25C P30307 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
MEN1 O00255 1/20 0.41

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
SCHEMBL1553043 0.84 TSHR (0.51) TSHRCYP1A2CDC25BALDH1A1HSD17B10
SCHEMBL117199 0.84 ILK (0.53) TSHRALDH1A1HSD17B10KDM4EL3MBTL1
SCHEMBL260372 0.83 ALDH1A1 (0.51) TSHRCYP1A2CDC25BALDH1A1HSD17B10
Bromide SCHEMBL261347 0.82 ALDH1A1 (0.50) TSHRCYP1A2CDC25BALDH1A1HSD17B10
SCHEMBL20969720 0.77 ALDH1A1 (0.46) TSHRALDH1A1HSD17B10KDM4EMAPT
SCHEMBL11691158 0.77 KMT2A (0.47) CYP1A2ALDH1A1KDM4EL3MBTL1MAPT
SCHEMBL11689605 0.76 ALDH1A1 (0.46) CYP1A2ALDH1A1KDM4EL3MBTL1MAPT
SCHEMBL29351134 0.75 NPC1 (0.52) CYP1A2ALDH1A1KDM4EMAPTGAA
SCHEMBL28705957 0.75 NPC1 (0.52) CYP1A2ALDH1A1KDM4EMAPTGAA
SCHEMBL11690001 0.74 SMN1; SMN2 (0.39) TSHRALDH1A1HSD17B10KDM4EL3MBTL1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159561-A1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES FMC CORP (US) 2023-05-25 US disclosed
US-11578085-B2 Heterocycle-substituted bicyclic azole pesticides FMC CORPORATION (US) 2023-02-14 US disclosed
EP-4105209-A2 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES FMC Corporation (US) 2022-12-21 EP disclosed
EP-3424919-B1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES FMC CORP (US) 2022-04-27 EP disclosed
CN-112679467-A Heterocyclic substituted bicyclic azoles as pesticidal agents FMC公司 2021-04-20 CN disclosed
CN-107635984-B Heterocyclic substituted bicyclic azoles as pesticidal agents FMC公司 2021-04-13 CN disclosed
CN-112608300-A Heterocyclic substituted bicyclic azoles as pesticidal agents FMC公司 2021-04-06 CN disclosed
US-20210017192-A1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES FMC CORP (US) 2021-01-21 US disclosed
US-10822351-B2 Heterocycle-substituted bicyclic azole pesticides FMC CORPORATION (US) 2020-11-03 US disclosed
EP-3567036-A1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES FMC Corporation (US) 2019-11-13 EP disclosed
EP-3424919-A1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES FMC Corporation (US) 2019-01-09 EP disclosed
US-10150782-B2 Heterocycle-substituted bicyclic azole pesticides FMC CORPORATION (US) 2018-12-11 US disclosed
EP-3044220-B1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES FMC CORP (US) 2018-11-07 EP disclosed
US-20180009827-A1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES E I du Ponte de Nemours and Company (US) 2018-01-11 US disclosed
US-9802961-B2 Heterocycle-substituted bicyclic azole pesticides E I DU PONT DE NEMOURS AND COMPANY (US) 2017-10-31 US disclosed
US-20170174707-A1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES FMC CORPORATION 2017-06-22 US disclosed
WO-2016144351-A1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2016-09-15 WO disclosed
EP-3044220-A1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES E. I. du Pont de Nemours and Company (US) 2016-07-20 EP disclosed
WO-2015038503-A1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2015-03-19 WO disclosed
US-20120129854-A1 Pesticidal Arylpyrrolidines BAYER CROPSCIENCE AG (DE) 2012-05-24 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 (8 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-10822351-B2 Heterocycle-substituted bicyclic azole pesticides CYP4X1, DDT, CHRM1 TSHR 1382/4885CYP1A2 48/4885CDC25B 300/4885
US-20230159561-A1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES CYP4X1, DDT, CHRM1 TSHR 1382/4885CYP1A2 48/4885CDC25B 300/4885
US-20120129854-A1 Pesticidal Arylpyrrolidines DDT, AADAC, AHR TSHR 255/4885CYP1A2 10/4885CDC25B 1769/4885
US-11578085-B2 Heterocycle-substituted bicyclic azole pesticides CYP4X1, DDT, CHRM1 TSHR 1382/4885CYP1A2 48/4885CDC25B 300/4885
US-20180009827-A1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES CYP4X1, DDT, CHRM1 TSHR 1382/4885CYP1A2 48/4885CDC25B 300/4885
US-10150782-B2 Heterocycle-substituted bicyclic azole pesticides CYP4X1, DDT, CHRM1 TSHR 1382/4885CYP1A2 48/4885CDC25B 300/4885
US-20210017192-A1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES CYP4X1, DDT, CHRM1 TSHR 1382/4885CYP1A2 48/4885CDC25B 300/4885
US-20170174707-A1 HETEROCYCLE-SUBSTITUTED BICYCLIC AZOLE PESTICIDES CYP4X1, DDT, CHRM1 TSHR 1382/4885CYP1A2 48/4885CDC25B 300/4885

“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.