SCHEMBL41078

SCHEMBL41078

CCCCCNNC(N)=S

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
TSHR P16473 1/20 0.40
HDAC1 Q13547 6/20 0.40
HDAC3 O15379 5/20 0.40
HDAC2 Q92769 5/20 0.40
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
EPHX1 P07099 6/20 0.37
HDAC11 Q96DB2 2/20 0.37
HDAC8 Q9BY41 2/20 0.37
HDAC6 Q9UBN7 1/20 0.37
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35

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
SCHEMBL28415125 0.98 HDAC1 (0.41) ALDH1A1TSHRHDAC1HDAC3HDAC2
SCHEMBL11226737 0.98 HDAC1 (0.41) ALDH1A1TSHRHDAC1HDAC3HDAC2
SCHEMBL28059471 0.98 HDAC1 (0.41) ALDH1A1TSHRHDAC1HDAC3HDAC2
SCHEMBL28968579 0.98 HDAC1 (0.41) ALDH1A1TSHRHDAC1HDAC3HDAC2
SCHEMBL6111687 0.98 HDAC1 (0.41) ALDH1A1TSHRHDAC1HDAC3HDAC2
SCHEMBL28059479 0.98 HDAC1 (0.41) ALDH1A1TSHRHDAC1HDAC3HDAC2
SCHEMBL11033679 0.98 HDAC1 (0.41) ALDH1A1TSHRHDAC1HDAC3HDAC2
SCHEMBL721193 0.93
SCHEMBL1489137 0.83
SCHEMBL7557328 0.78 HDAC1 (0.38) ALDH1A1TSHRHDAC1HDAC3HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2864333-B1 ETODOLAC DERIVATIVES AS HCV NS5B POLYMERASE INHIBITORS KUCUKGUZEL S GUNIZ (TR) 2017-07-19 EP claimed
EP-2864334-A1 SYNTHESIS OF THIOSEMICARBAZIDES AND TRIAZOLES DERIVED FROM ETODOLAC Kucukguzel, S. Guniz (TR) 2015-04-29 EP claimed
WO-2014003694-A1 SYNTHESIS OF THIOSEMICARBAZIDES AND TRIAZOLES DERIVED FROM ETODOLAC KUCUKGUZEL S GUNIZ (TR) 2014-01-03 WO claimed
US-20110281363-A1 SENSITIVE AND SELECTIVE DETECTION METHOD FOR MERCURY (II) IN AQUEOUS SOLUTION UNIVERSITY OF MAINE SYSTEM BOARD OF TRUSTEES 2011-11-17 US claimed
WO-1996011191-A1 SUBSTITUTED 3-PHENYL-1,2,3,4-OXATRIAZOLE-5-IMINES USEFUL FOR THE TREATMENT OF ASTHMA AND THROMBOSIS A/S GEA FARMACEUTISK FABRIK (DK) 1996-04-18 WO claimed
EP-0654028-B1 3- AND 5-SUBSTITUTED 1,2,3,4-OXATRIAZOLE-5-IMINE COMPOUNDS, A PROCESS FOR THE PREPARATION THEREOF, A PHARMACEUTICAL PREPARATION CONTAINING SAID COMPOUNDS AND THE USE OF SAID COMPOUNDS FOR THE PREPARATION OF MEDICAMENTS GEA FARMACEUTISK FABRIK AS (DK) 1996-04-17 EP claimed
EP-0654028-A1 3- AND 5-SUBSTITUTED 1,2,3,4-OXATRIAZOLE-5-IMINE COMPOUNDS, A PROCESS FOR THE PREPARATION THEREOF, A PHARMACEUTICAL PREPARATION CONTAINING SAID COMPOUNDS AND THE USE OF SAID COMPOUNDS FOR THE PREPARATION OF MEDICAMENTS. GEA FARMACEUTISK FABRIK AS (DK) 1995-05-24 EP claimed
EP-0571485-B1 3-SUBSTITUTED 1,2,3,4-OXATRIAZOLE-5-IMINE COMPOUNDS, A PROCESS FOR THE PREPARATION THEREOF AND A PHARMACEUTICAL PREPARATION CONTAINING SAID COMPOUNDS GEA FARMACEUTISK FABRIK AS (DK) 1994-09-14 EP claimed
WO-1994003442-A1 3- AND 5-SUBSTITUTED 1,2,3,4-OXATRIAZOLE-5-IMINE COMPOUNDS, A PROCESS FOR THE PREPARATION THEREOF, A PHARMACEUTICAL PREPARATION CONTAINING SAID COMPOUNDS AND THE USE OF SAID COMPOUNDS FOR THE PREPARATION OF MEDICAMENTS A/S GEA FARMACEUTISK FABRIK (DK) 1994-02-17 WO claimed
EP-0571485-A1 3-SUBSTITUTED 1,2,3,4-OXATRIAZOLE-5-IMINE COMPOUNDS, A PROCESS FOR THE PREPARATION THEREOF AND A PHARMACEUTICAL PREPARATION CONTAINING SAID COMPOUNDS. GEA FARMACEUTISK FABRIK AS (DK) 1993-12-01 EP claimed
WO-1992013847-A1 3-SUBSTITUTED 1,2,3,4-OXATRIAZOLE-5-IMINE COMPOUNDS, A PROCESS FOR THE PREPARATION THEREOF AND A PHARMACEUTICAL PREPARATION CONTAINING SAID COMPOUNDS A/S GEA FARMACEUTISK FABRIK (DK) 1992-08-20 WO claimed
EP-0155486-A1 1,3,5-Trisubstituted 1,2,4-triazole derivatives, process for their preparation and medicinal preparations containing them ALKALOIDA VEGYéSZETI GYáR (HU) 1985-09-25 EP claimed
JP-6345725-A None JP disclosed
JP-59010574-A None JP disclosed
JP-5286950-A None JP disclosed
WO-2023132937-A1 ORGANIC COLORANTS, INCLUDING PIGMENTS AND DYES, FOR PLASTICS, INKS, PAINTS, COATINGS, AND OTHER APPLICATIONS KEBOTIX, INC. (US) 2023-07-13 WO disclosed
JP-S5910574-A TRIAZOLE DERIVATIVE AND ITS PREPARATION FUJISAWA PHARMACEUT CO LTD 1984-01-20 JP disclosed
US-4255435-A INSECTICIDES, NEMATOCIDES THE BOOTS COMPANY LIMITED (GB) 1981-03-10 US disclosed
US-4128412-A Herbicidal composition and method using N-(2-ethylsulfonyl-1,3,4-thiadiazol-5-yl)-N-methyl-N'-methyl urea BAYER AKTIENGESELLSCHAFT (DE) 1978-12-05 US disclosed
US-4049670-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-09-20 US disclosed