SCHEMBL159671

SCHEMBL159671

COC(=O)Nc1nc2ccccc2n1C(=O)NCCSC

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.74
ALDH1A1 P00352 2/20 0.74
ASAH1 Q13510 8/20 0.47
L3MBTL1 Q9Y468 1/20 0.45
POLB P06746 1/20 0.40
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 2/20 0.38
MAPK1 P28482 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
MAPT P10636 1/20 0.38
PKM P14618 1/20 0.38
KDM4E B2RXH2 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
HPGD P15428 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL205803 0.87 TSHR (0.87) TSHRALDH1A1ASAH1L3MBTL1POLB
Benomyl SCHEMBL15681 0.85 TSHR (1.00) TSHRALDH1A1ASAH1POLBRAB9A
Benomyl SCHEMBL8379451 0.85 TSHR (1.00) TSHRALDH1A1ASAH1POLBRAB9A
Benomyl SCHEMBL29379464 0.85 TSHR (1.00) TSHRALDH1A1ASAH1POLBRAB9A
SCHEMBL9578798 0.84 TSHR (0.78) TSHRALDH1A1ASAH1L3MBTL1POLB
Benomyl SCHEMBL3962065 0.84 TSHR (0.98) TSHRALDH1A1ASAH1POLBRAB9A
Fuberidazole SCHEMBL22833870 0.84 ALDH1A1 (0.54) TSHRALDH1A1ASAH1L3MBTL1POLB
SCHEMBL28539606 0.84 TSHR (0.53) TSHRALDH1A1ASAH1L3MBTL1RAB9A
SCHEMBL9578770 0.83 TSHR (0.91) TSHRALDH1A1ASAH1LMNAKDM4E
SCHEMBL745175 0.82 ALDH1A1 (0.52) TSHRALDH1A1L3MBTL1POLBRAB9A

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

Appears in 3294 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3060043-B1 PESTICIDAL COMPOSITIONS AND RELATED METHODS CORTEVA AGRISCIENCE LLC (US) 2025-11-26 EP claimed
EP-3578542-B1 COMPOSITIONS HAVING PESTICIDAL UTILITY AND PROCESSES RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2025-11-12 EP claimed
EP-3578543-B1 COMPOSITIONS COMPRISING MOLECULES HAVING PESTICIDAL UTILITY AND PROCESSES RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2025-08-20 EP claimed
EP-3578541-B1 COMPOSITIONS COMPRISING MOLECULES HAVING PESTICIDAL UTILITY, AND PROCESSES RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2025-05-28 EP claimed
US-20240188569-A1 NEW YEAST STRAIN AND ITS USES FOR THE CONTROL OF PHYTOPATHOGENS AGROVENTURES LLC (US) 2024-06-13 US claimed
US-20240138408-A1 COMPOSITION COMPRISING BENZYLAMINE ACARICIDE AND USE THEREOF SHANGDONG KANGIAO BIO-TECHNOLOGY CO., LTD (CN) 2024-05-02 US claimed
EP-4331364-A2 COMPOSITIONS HAVING PESTICIDAL UTILITY AND PROCESSES RELATED THERETO Corteva Agriscience LLC (US) 2024-03-06 EP claimed
EP-4323496-A1 NEW YEAST STRAIN AND ITS USES FOR THE CONTROL OF PHYTOPATHOGENS AGROVENTURES S.R.L. (IT) 2024-02-21 EP claimed
WO-2023212494-A2 PREDICTIVE PESTICIDE RESISTANCE INFORMATION GENERATION AND USE PIONEER HI-BRED INTERNATIONAL, INC. (US) 2023-11-02 WO claimed
EP-3614845-B1 FUNGICIDAL COMBINATIONS UPL LTD (IN) 2023-11-01 EP claimed
US-20100249199-A1 Hard Surface Treatment Compositions with Improved Mold or Fungi Remediation Properties RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2010-09-30 US claimed
US-7795456-B2 Insecticidal N-substituted sulfoximines DOW AGROSCIENCES LLC (US) 2010-09-14 US claimed
WO-2010043553-A1 PESTICIDAL MIXTURES COMPRISING METAFLUMIZONE AND A FUNGICIDAL COMPOUND BASF SE (DE) 2010-04-22 WO claimed
WO-2010030824-A1 GELATINOUS ELASTOMER COMPOSITIONS SILIPOS, INC. (US) 2010-03-18 WO claimed
US-20100063008-A1 GELATINOUS ELASTOMER COMPOSITIONS SILIPOS, INC. (US) 2010-03-11 US claimed
US-20070155706-A1 Active substance combinations that have nemticidal, insecticidal, and fungicidal properties and are based on trifluorobutenyl compounds ADAMA MAKHTESHIM LTD. (IL) 2007-07-05 US claimed
JP-2006525250-A 2006-11-09 JP claimed
EP-1622453-A1 ACTIVE SUBSTANCE COMBINATIONS THAT HAVE NEMATICIDAL, INSECTICIDAL, AND FUNGICIDAL PROPERTIES AND ARE BASED ON TRIFLUOROBUTENYL COMPOUNDS Bayer CropScience AG (DE) 2006-02-08 EP claimed
WO-2004095929-A1 ACTIVE SUBSTANCE COMBINATIONS THAT HAVE NEMATICIDAL, INSECTICIDAL, AND FUNGICIDAL PROPERTIES AND ARE BASED ON TRIFLUOROBUTENYL COMPOUNDS BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-11-11 WO claimed
WO-2001056358-A2 ENHANCED PROPERTIED PESTICIDES ROHM AND HAAS COMPANY (US) 2001-08-09 WO claimed