SCHEMBL394950

SCHEMBL394950

C=CCNC(=S)NNC(=S)NC

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.49
ATM Q13315 1/20 0.47
ALDH1A1 P00352 2/20 0.46
TSHR P16473 1/20 0.46
GAA P10253 5/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
CA1 P00915 2/20 0.46
CA9 Q16790 2/20 0.46
ALPL P05186 1/20 0.45
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL5141900 0.91 ALDH1A1 (0.53) POLBATMALDH1A1TSHRGAA
SCHEMBL1733093 0.89
Methallibure SCHEMBL6614118 0.85 ATM (0.45) POLBATMALDH1A1GAASMN1; SMN2
SCHEMBL12725358 0.84
SCHEMBL7976644 0.83 ALDH1A1 (0.50) POLBATMALDH1A1TSHRGAA
SCHEMBL5185769 0.78 ALDH1A1 (0.64) POLBATMALDH1A1TSHRGAA
SCHEMBL325076 0.78 ALDH1A1 (0.62) POLBALDH1A1TSHRGAASMN1; SMN2
SCHEMBL11362496 0.77 ALDH1A1 (0.56) POLBATMALDH1A1TSHRGAA
SCHEMBL8553282 0.76 POLB (0.51) POLBATMALDH1A1GAASMN1; SMN2
Iodide SCHEMBL8715119 0.76 ALDH1A1 (0.59) POLBALDH1A1TSHRGAASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2460408-A1 Nematicidal compositions deVGen N.V. (BE) 2012-06-06 EP claimed
US-20220204540-A1 ESTERS OF NON- AROMATIC HETEROCYCLIC COMPOUNDS HAVING A NEMATOCIDAL ACTIVITY, THEIR AGRONOMIC COMPOSITIONS AND USE THEREOF BANK OF AMERICA, N.A., AS ADMINISTRATIVE AGENT 2022-06-30 US disclosed
EP-3962900-A1 ESTERS OF NON- AROMATIC HETEROCYCLIC COMPOUNDS HAVING A NEMATOCIDAL ACTIVITY, THEIR AGRONOMIC COMPOSITIONS AND USE THEREOF ISAGRO S.p.A. (IT) 2022-03-09 EP disclosed
US-20210127678-A1 ESTERS OF HETEROCYCLIC COMPOUNDS HAVING A NEMATOCIDAL ACTIVITY, THEIR AGRONOMIC COMPOSITIONS AND THEIR USE ISAGRO S.P.A. (IT) 2021-05-06 US disclosed
US-10874107-B2 β-lactamase targeted photosensitizer for pesticide and pest detection THE GENERAL HOSPITAL CORPORATION (US) 2020-12-29 US disclosed
WO-2020222118-A1 ESTERS OF NON- AROMATIC HETEROCYCLIC COMPOUNDS HAVING A NEMATOCIDAL ACTIVITY, THEIR AGRONOMIC COMPOSITIONS AND USE THEREOF. ISAGRO S.P.A. (IT) 2020-11-05 WO disclosed
US-20200281208-A1 USE OF CRYSTALLINE FORMS OF COPPER SALICYLATE FOR THE CONTROL OF PHYTOPATHOGENIC BACTERIA ISAGRO S.P.A. (IT) 2020-09-10 US disclosed
US-20200154710-A1 BETA-LACTAMASE TARGETED PHOTOSENSITIZER FOR PESTICIDE AND PEST DETECTION BANK OF AMERICA, N.A., AS ADMINISTRATIVE AGENT 2020-05-21 US disclosed
WO-2019186498-A1 ESTERS OF HETEROCYCLIC COMPOUNDS HAVING A NEMATOCIDAL ACTIVITY, THEIR AGRONOMIC COMPOSITIONS AND THEIR USE ISAGRO S.P.A. (IT) 2019-10-03 WO disclosed
EP-3393248-B1 USE OF CRYSTALLINE FORMS OF COPPER SALICYLATE FOR THE CONTROL OF PHYTOPATHOGENIC BACTERIA ISAGRO SPA (IT) 2019-08-14 EP disclosed
WO-2001002378-A1 NEMATICIDAL TRIFLUOROBUTENES NIHON BAYER AGROCHEM K.K. (DE) 2001-01-11 WO disclosed
WO-2000073290-A1 ISOTHIAZOLECARBOXAMIDES AND THEIR USE AS MICROBICIDES NIHON BAYER AGROCHEM K.K. (JP) 2000-12-07 WO disclosed
WO-2000063188-A1 (-)-ENANTIOMER OF THE 2-[2-(1- CHLOROCYCLOPROPYL)-3- (2-CHLOROPHENYL) -2- HYDROXYPROPYL] -2,4- DIHYDRO- [1,2,4] -TRIAZOLE -3-THIONE BAYER AKTIENGESELLSCHAFT (DE) 2000-10-26 WO disclosed
WO-2000018742-A1 SULFONYLTRIAZOL DERIVATIVES AND THEIR USE FOR COMBATING MICRO-ORGANISMS BAYER AKTIENGESELLSCHAFT (DE) 2000-04-06 WO disclosed
WO-2000015620-A1 SULFONYL OXAZOLONES AND THEIR USE FOR COMBATING UNDESIRABLE MICROORGANISMS BAYER AKTIENGESELLSCHAFT (DE) 2000-03-23 WO disclosed
WO-2000014071-A2 PYRAZOLE CARBOXANILIDE FUNGICIDE BAYER AKTIENGESELLSCHAFT (DE) 2000-03-16 WO disclosed
WO-2000003995-A1 DIPHENYLIMIDAZOLINES BAYER AKTIENGESELLSCHAFT (DE) 2000-01-27 WO disclosed
US-4697020-A Derivatives of 2,4-thiazolidinedione CIBA-GEIGY CORPORATION (US) 1987-09-29 US disclosed
US-4268640-A CURING AGENT OF MONO OR DI-THIOBIUREA OSAKA SODA CO. LTD. (JP) 1981-05-19 US disclosed
US-4093462-A 2,5-Bis(secondary amino) oxa- and thiadiazole photographic developing agents EASTMAN KODAK COMPANY (US) 1978-06-06 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 (4 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-10874107-B2 β-lactamase targeted photosensitizer for pesticide and pest detection DDT, BCHE, GUSB POLB 1455/4885ATM 1933/4885ALDH1A1 500/4885
US-20220204540-A1 ESTERS OF NON- AROMATIC HETEROCYCLIC COMPOUNDS HAVING A NEMATOCIDAL ACTIVITY, THEIR AGRONOMIC COMPOSITIONS AND USE THEREOF ACHE, CYP51A1, DNPH1 POLB 4258/4885ATM 4609/4885ALDH1A1 1226/4885
US-20210127678-A1 ESTERS OF HETEROCYCLIC COMPOUNDS HAVING A NEMATOCIDAL ACTIVITY, THEIR AGRONOMIC COMPOSITIONS AND THEIR USE CYP51A1, ACHE, CYP8B1 POLB 3597/4885ATM 4694/4885ALDH1A1 719/4885
US-20200154710-A1 BETA-LACTAMASE TARGETED PHOTOSENSITIZER FOR PESTICIDE AND PEST DETECTION DDT, BCHE, GUSB POLB 1217/4885ATM 2083/4885ALDH1A1 479/4885

“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.