SCHEMBL4604619

SCHEMBL4604619

CCCSP(O)(=S)OCC

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CYP3A4 P08684 1/20 0.41
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
TDP1 Q9NUW8 1/20 0.36
TSHR P16473 1/20 0.35
LPAR2 Q9HBW0 3/20 0.34
LPAR3 Q9UBY5 3/20 0.34

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
Ammonia Solution, Strong SCHEMBL11610686 0.98 ALDH1A1 (0.39) ALDH1A1HSD17B10CYP3A4MEN1KMT2A
Potassium SCHEMBL11442510 0.98 ALDH1A1 (0.39) ALDH1A1HSD17B10CYP3A4MEN1KMT2A
Hydrochloric Acid SCHEMBL8983797 0.98 ALDH1A1 (0.39) ALDH1A1HSD17B10CYP3A4MEN1KMT2A
Dimethylamine SCHEMBL10692614 0.94 ALDH1A1 (0.37) ALDH1A1HSD17B10CYP3A4MEN1KMT2A
SCHEMBL27341027 0.90 ALDH1A1 (0.35) ALDH1A1HSD17B10CYP3A4MEN1KMT2A
SCHEMBL11572694 0.89 LPAR3 (0.42) ALDH1A1HSD17B10CYP3A4MEN1KMT2A
SCHEMBL11124800 0.85 LPAR3 (0.44) ALDH1A1HSD17B10CYP3A4LPAR2LPAR3
SCHEMBL482319 0.84 LPAR2 (0.38) ALDH1A1HSD17B10CYP3A4MEN1KMT2A
Phosphoric Acid SCHEMBL11537487 0.84 LPAR3 (0.38) ALDH1A1HSD17B10CYP3A4LPAR2LPAR3
Dimethylamine SCHEMBL10905577 0.84 LPAR2 (0.38) ALDH1A1HSD17B10CYP3A4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0215570-B1 ORGANO PHOSPORIC ACID DITHIOESTER INSECTICIDES HIRONORI KUSHIBIKI (JP) 1990-01-31 EP claimed
EP-0215570-A1 Organo phosporic acid dithioester insecticides HIRONORI KUSHIBIKI (JP) 1987-03-25 EP claimed
CN-86106243-A Organic dithiophosphate, process for producing the same, and pesticide containing the same 1987-03-04 CN claimed
EP-0012344-B1 O-PYRAZOL-4-YL-O-ETHYL-S-N-PROPYL-(THIONO)THIOL-PHOSPHORIC-ACID ESTERS, PROCESS FOR PREPARING THEM AND THEIR USE AS PESTICIDES BAYER AG (DE) 1981-08-12 EP claimed
EP-0009103-B1 N-(O-ETHYL-S-N-PROPYL-(DI)THIOPHOSPHORYLOXY)-NAPHTALIMIDES, PROCESS FOR THEIR PREPARATION, PESTICIDAL COMPOSITIONS CONTAINING THEM, THEIR PREPARATION AND USE BAYER AG (DE) 1981-04-29 EP claimed
US-4110440-A ARTHROPODICIDE, NEMATOCIDE NIHON TOKUSHU NOYAKU SEIZO K.K. (JP) 1978-08-29 US claimed
JP-62039595-A None JP disclosed
JP-56138103-A None JP disclosed
JP-56138104-A None JP disclosed
EP-1945344-A2 PHOTO-RESPONSIVE MICROENCAPSULATION MATERIALS, COMPOSITIONS AND METHODS OF USE THEREOF Solarbre, Inc. (US) 2008-07-23 EP disclosed
WO-2007051198-A2 PHOTO-RESPONSIVE MICROENCAPSULATION MATERIALS, COMPOSITIONS AND METHODS OF USE THEREOF SOLARBRE, INC (US) 2007-05-03 WO disclosed
US-20030087958-A1 Hydrazine oxoacetamide derivative and insecticide AGRO-KANESHO CO., LTD. (JP) 2003-05-08 US disclosed
US-6399659-B2 EFFECTIVE AT LOW CONCENTRATIONS AGRO-KANESHO CO., LTD. (JP) 2002-06-04 US disclosed
US-4028377-A PESTICIDES, INSECTICIDES, MITICIDES CIBA-GEIGY CORPORATION (US) 1977-06-07 US disclosed
US-4013794-A O-ALKYL-S-ALKYL-O-PHENYL PHOSPHATES AND INSECTICIDAL AND ACARICIDAL METHOD OF USE BAYER AKTIENGESELLSCHAFT (DT) 1977-03-22 US disclosed
US-3966920-A O,S-Dialkyl-O-(2-cyanophenyl)-thionothiolphosphoric acid esters and insecticidal and acaricidal compositions and method BAYER AKTIENGESELLSCHAFT (DT) 1976-06-29 US disclosed
US-3966850-A INSECTICIDES, ACARACIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-06-29 US disclosed
US-3950334-A INSECTICIDES, MITICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-04-13 US disclosed
US-3934011-A Combating insects and acarids with S-diphenylmethyl-dithiophosphates CIBA-GEIGY CORPORATION (US) 1976-01-20 US disclosed
US-3933947-A INSECTICIDE, MITICIDE, NEMATOCIDE BAYER AKTIENGESELLSCHAFT (DT) 1976-01-20 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-20030087958-A1 Hydrazine oxoacetamide derivative and insecticide DDT, CYP2E1, HCN1 ALDH1A1 596/4885HSD17B10 928/4885CYP3A4 29/4885

“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.