SCHEMBL2254530

SCHEMBL2254530

O=C(O)NC(=S)Nc1ccccc1NC(=S)NC(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.63
HPGD P15428 2/20 0.63
LMNA P02545 2/20 0.63
ALOX15 P16050 1/20 0.63
HSD17B10 Q99714 1/20 0.63
EPHX1 P07099 3/20 0.59
KDM4E B2RXH2 2/20 0.54
POLB P06746 1/20 0.54
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
ALOX12 P18054 2/20 0.51
KMT2A Q03164 3/20 0.50
CRHBP P24387 1/20 0.50
NPBWR1 P48145 1/20 0.50
CRHR2 Q13324 1/20 0.50
MCHR1 Q99705 1/20 0.50
MAPT P10636 2/20 0.49
MEN1 O00255 2/20 0.49

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
SCHEMBL11681834 0.91 ALDH1A1 (0.59) ALDH1A1HPGDLMNAALOX15HSD17B10
SCHEMBL13371996 0.88 ALDH1A1 (0.51) ALDH1A1HPGDLMNAALOX15HSD17B10
SCHEMBL11761177 0.87 HDAC3 (0.56) ALDH1A1HPGDLMNAALOX15HSD17B10
SCHEMBL12336304 0.83 ALDH1A1 (0.64) ALDH1A1HPGDLMNAALOX15HSD17B10
SCHEMBL23728134 0.83 EPHX1 (0.71) ALDH1A1LMNAHSD17B10EPHX1KDM4E
SCHEMBL4170829 0.82 GAA (0.52) ALDH1A1HPGDLMNAALOX15HSD17B10
SCHEMBL6118209 0.82 EPHX1 (0.78) ALDH1A1HPGDLMNAEPHX1KDM4E
SCHEMBL11679883 0.81 SMN1; SMN2 (0.63) ALDH1A1HPGDLMNAALOX15HSD17B10
SCHEMBL27463422 0.81 EPHX1 (0.79) ALDH1A1HPGDLMNAALOX15HSD17B10
Thiophanate Methyl SCHEMBL28315984 0.80 ALDH1A1 (0.96) ALDH1A1HPGDLMNAALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3352571-A1 NOVEL PLANT PROTECTING COMPOSITIONS AND USES THEREOF Flechsig Patent Company LLC (CH) 2018-08-01 EP claimed
WO-2017050428-A1 NOVEL PLANT PROTECTING COMPOSITIONS AND USES THEREOF FLECHSIG PATENT COMPANY LLC (CH) 2017-03-30 WO claimed
EP-0984688-B1 FUNGICIDAL MIXTURES BASF AG (DE) 2003-07-23 EP claimed
EP-1041884-B1 FUNGICIDE MIXTURES BASED ON PYRIDIN CARBOXAMIDES AND BENZIMIDAZOLES OR THE PRECURSORS THEREOF BASF AG (DE) 2002-09-25 EP claimed
EP-0712278-B1 N-PYRIDYLTOLUIDINE-CONTAINING FUNGICIDAL WATER DISPERSIBLE GRANULES ISHIHARA SANGYO KAISHA (JP) 2001-06-13 EP claimed
EP-0984688-A1 FUNGICIDAL MIXTURES BASF AKTIENGESELLSCHAFT (DE) 2000-03-15 EP claimed
WO-1998053688-A1 FUNGICIDAL MIXTURES BASF AKTIENGESELLSCHAFT (DE) 1998-12-03 WO claimed
EP-0337103-B1 BIOCIDAL COMPOSITION ISHIHARA SANGYO KAISHA, Ltd. (JP) 1993-02-10 EP claimed
US-20220211035-A1 METHODS TO FORMULATE NEUTRAL ORGANIC COMPOUNDS WITH POLYMER NANOPARTICLES SILICON VALLEY BANK (CA) 2022-07-07 US disclosed
EP-3378310-B1 METHODS TO PRODUCE POLYMER NANOPARTICLES AND FORMULATIONS OF ACTIVE INGREDIENTS VIVE CROP PROT INC (CA) 2021-08-04 EP disclosed
EP-3356356-B1 COMPOUNDS USEFUL AS MODULATORS OF TRPM8 FIRMENICH INCORPORATED (US) 2021-05-26 EP disclosed
US-20200260724-A1 METHODS TO FORMULATE NEUTRAL ORGANIC COMPOUNDS WITH POLYMER NANOPARTICLES SILICON VALLEY BANK (CA) 2020-08-20 US disclosed
US-20190307129-A1 METHODS TO PRODUCE POLYMER NANOPARTICLES AND FORMULATIONS OF ACTIVE INGREDIENTS VIVE CROP PROTECTION INC. (CA) 2019-10-10 US disclosed
US-10392371-B2 Compounds useful as modulators of TRPM8 SENOMYX, INC. (US) 2019-08-27 US disclosed
US-4783451-A Organophosphorus, compounds and insecticidal, miticidal, nematicidal or soil pesticidal compositions containing them ISHIHARA SANGYO KAISHA LTD. (JP) 1988-11-08 US disclosed
US-4774335-A MONO THIOCYANATION OF HALO PYRIMIDINES MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1988-09-27 US disclosed
WO-1987006430-A1 FUNGICIDAL TRIAZOLES AND IMIDAZOLES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-11-05 WO disclosed
US-4652569-A Thiocyanopyrimidine, agricultural and horticultural fungicide containing same MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1987-03-24 US disclosed
US-4645761-A Organophosphorus compounds and insecticidal, miticidal, nematicidal or soil pesticidal compositions containing them ISHIHARA SANGYO KAISHA, LTD. (JP) 1987-02-24 US disclosed
US-4590182-A Organophosphorus compound and insecticidal, miticidal or nematicidal composition containing it ISHIHARA SANGYO KAISHA LTD. (JP) 1986-05-20 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 (1 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-10392371-B2 Compounds useful as modulators of TRPM8 TRPM8, TRPM4, TRPM6 ALDH1A1 3726/4885HPGD 2402/4885LMNA 3784/4885

“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.