SCHEMBL233663

SCHEMBL233663

c1csc(N2CCCCC2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
MEN1 O00255 3/20 0.50
HPGD P15428 1/20 0.49
GRM5 P41594 1/20 0.45
GRM1 Q13255 1/20 0.45
HSD17B10 Q99714 1/20 0.44
SLC6A7 Q99884 1/20 0.44
DRD2 P14416 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HTR2A P28223 1/20 0.43
HRH1 P35367 1/20 0.43
SCD O00767 1/20 0.42
KMT2A Q03164 1/20 0.41
HTT P42858 1/20 0.41
OGA O60502 1/20 0.40
CTSB P07858 1/20 0.40
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40

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
SCHEMBL13711959 1.00 NPC1 (0.51) NPC1RAB9AMEN1HPGDGRM5
SCHEMBL160290 0.98 NPC1 (0.53) NPC1RAB9AMEN1HPGDGRM5
Methane SCHEMBL27085490 0.96 NPC1 (0.51) NPC1RAB9AMEN1HPGDGRM5
Bromide SCHEMBL6317924 0.96 NPC1 (0.51) NPC1RAB9AMEN1HPGDGRM5
SCHEMBL15058848 0.93
Formamide SCHEMBL28418050 0.89 ALDH1A1 (0.47) NPC1RAB9AMEN1HPGDGRM5
SCHEMBL29102030 0.89
SCHEMBL25494359 0.88 NPC1 (0.50) NPC1RAB9AMEN1HPGDGRM5
Isoxazole SCHEMBL28209104 0.83 DRD2 (0.40) NPC1RAB9AMEN1HPGDGRM5
SCHEMBL17224666 0.82 NPC1 (0.40) NPC1RAB9AMEN1HPGDGRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250151731-A1 METHYLOBACTERIUM COMPOSITIONS FOR FUNGAL DISEASE CONTROL NEWLEAF SYMBIOTICS, INC. 2025-05-15 US claimed
US-20240251787-A1 AGROCHEMICAL COMPOSITION, AGROCHEMICAL FORMULATION, USE OF A DIOXABICYCLOALKANE DERIVATIVE, AND, METHOD FOR THE TREATMENT AND/OR PREVENTION OF DISEASES OR PESTS IN A PLANT OR PLANT SEED OXITENO S.A. INDÚSTRIA E COMÉRCIO (BR) 2024-08-01 US claimed
US-20240245055-A1 METHYLOBACTERIUM COMPOSITIONS FOR FUNGAL DISEASE CONTROL NEWLEAF SYMBIOTICS, INC. (US) 2024-07-25 US claimed
EP-4337008-A1 AGROCHEMICAL COMPOSITION, AGROCHEMICAL FORMULATION, USE OF A DIOXABICYCLOALKANE DERIVATIVE, AND, METHOD FOR THE TREATMENT AND/OR PREVENTION OF DISEASES OR PESTS IN A PLANT OR PLANT SEED Oxiteno S.A. Indústria e Comércio (BR) 2024-03-20 EP claimed
US-20230380418-A1 COMPOSITION, AGROCHEMICAL FORMULATION, METHODS FOR INCREASING WATER AND NUTRIENT AVAILABILITY AND FOR IMPROVING PEST CONTROL IN PLANTS AND SEEDS, AND THE AGROCHEMICAL FORMULATION OXITENO S.A. INDÚSTRIA E COMÉRCIO (BR) 2023-11-30 US claimed
CN-111491918-B Aryl and heteroaryl substituted indole compounds 百时美施贵宝公司 2023-10-24 CN claimed
EP-4229027-A1 COMPOSITION, AGROCHEMICAL FORMULATION, METHODS FOR INCREASING WATER AND NUTRIENT AVAILABILITY AND FOR IMPROVING PEST CONTROL IN PLANTS AND SEEDS, AND USES OF THE COMPOSITION AND THE AGROCHEMICAL FORMULATION Oxiteno S.A. Indústria e Comércio (BR) 2023-08-23 EP claimed
CN-116096696-A Compositions, agrochemicals, methods for increasing water and nutrient availability and improving pest control in plants and seeds, and uses of said compositions and said agrochemicals 奥克西泰诺工业和贸易公司 2023-05-09 CN claimed
CN-115530175-A Agrochemical combinations UPL有限公司 2022-12-30 CN claimed
WO-2022236389-A1 AGROCHEMICAL COMPOSITION, AGROCHEMICAL FORMULATION, USE OF A DIOXABICYCLOALKANE DERIVATIVE, AND, METHOD FOR THE TREATMENT AND/OR PREVENTION OF DISEASES OR PESTS IN A PLANT OR PLANT SEED OXITENO S.A. INDÚSTRIA E COMÉRCIO (BR) 2022-11-17 WO claimed
US-20130190353-A1 FUNGICIDE COMPOSITION COMPRISING A TETRAZOLYLOXIME DERIVATIVE AND A THIAZOLYLPIPERIDINE DERIVATIVE BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-07-25 US claimed
CN-102459254-A Thiazolylpiperidine derivatives as fungicides BAYER CROPSCIENCE AG 2012-05-16 CN claimed
EP-2445907-A1 THIAZOLYLPIPERIDINE DERIVATES AS FUNGICIDES Bayer Cropscience AG (DE) 2012-05-02 EP claimed
WO-2012045798-A1 FUNGICIDE COMPOSITION COMPRISING A TETRAZOLYLOXIME DERIVATIVE AND A THIAZOLYLPIPERIDINE DERIVATIVE BAYER CROPSCIENCE AG (DE) 2012-04-12 WO claimed
US-20110294777-A1 BETA-LACTAMASE INHIBITORS MERCK SHARP & DOHME CORP. 2011-12-01 US claimed
US-20110046178-A1 Thiazolylpiperidine Derivatives as Fungicides BAYER CROPSCIENCE AG (DE) 2011-02-24 US claimed
EP-2272846-A1 Thiazolylpiperidine derivatives as fungicide Bayer CropScience AG (DE) 2011-01-12 EP claimed
WO-2010149275-A1 THIAZOLYLPIPERIDINE DERIVATES AS FUNGICIDES BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2010-12-29 WO claimed
EP-2231667-A2 BETA-LACTAMASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2010-09-29 EP claimed
WO-2009091856-A2 BETA-LACTAMASE INHIBITORS MERCK & CO., INC. (US) 2009-07-23 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20110294777-A1 BETA-LACTAMASE INHIBITORS MGAM, RPIA, LBR NPC1 2474/4885RAB9A 972/4885MEN1 3789/4885
US-20130190353-A1 FUNGICIDE COMPOSITION COMPRISING A TETRAZOLYLOXIME DERIVATIVE AND A THIAZOLYLPIPERIDINE DERIVATIVE THUMPD1, TH, PTMS NPC1 3326/4885RAB9A 4550/4885MEN1 3225/4885
US-20110046178-A1 Thiazolylpiperidine Derivatives as Fungicides NAT1, GRHPR, PTPRG NPC1 2257/4885RAB9A 1550/4885MEN1 801/4885

“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.