SCHEMBL262369

SCHEMBL262369

N#CNC(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.54
HDAC3 O15379 1/20 0.54
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
IDO1 P14902 1/20 0.54
HDAC1 Q13547 1/20 0.54
CA9 Q16790 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54
HSD17B10 Q99714 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
NCOR2 Q9Y618 1/20 0.54
GAA P10253 1/20 0.50
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
PTGS2 P35354 1/20 0.47
KMT2A Q03164 5/20 0.45
ALDH1A1 P00352 3/20 0.45

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
SCHEMBL17099926 0.98 ALOX15 (0.52) ALOX15HDAC3CA12CA1IDO1
Bromide SCHEMBL28425573 0.98 ALOX15 (0.52) ALOX15HDAC3CA12CA1IDO1
SCHEMBL11038788 0.88 ALDH1A1 (0.41) ALOX15HDAC3CA12CA1IDO1
SCHEMBL30089562 0.85 HDAC3 (0.39) ALOX15HDAC3CA12CA1IDO1
SCHEMBL11400756 0.85 ALDH1A1 (0.46) ALOX15HDAC3CA12CA1IDO1
SCHEMBL10932731 0.84 HDAC6 (0.47) HDAC1HDAC2HSD17B10HDAC8HDAC6
SCHEMBL8961322 0.80 ALDH1A1 (0.33) ALOX15HDAC3CA12CA1IDO1
SCHEMBL10335220 0.79 GAA (0.53) GAAKMT2AMEN1SMN1; SMN2
SCHEMBL11044094 0.79 KMT2A (0.46) ALOX15GAAKMT2AALDH1A1POLB
SCHEMBL554489 0.79 ALOX15 (0.56) ALOX15HDAC3CA12CA1IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4491613-A2 METHOD FOR PRODUCING PURIFIED PHTHALONITRILE AND METHOD FOR PURIFYING PHTHALONITRILE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2025-01-15 EP claimed
EP-4112598-B1 METHOD FOR PRODUCING PURIFIED PHTHALONITRILE AND METHOD FOR PURIFYING PHTHALONITRILE MITSUBISHI GAS CHEMICAL CO (JP) 2024-12-18 EP claimed
CN-119080882-A Eptifibatide derivative and preparation method thereof 山西医科大学 2024-12-06 CN claimed
CN-118852568-A Efficient, green and universal fusion synthesis method for covalent organic frameworks 浙江大学杭州国际科创中心 2024-10-29 CN claimed
CN-115175897-B Process for producing purified phthalonitriles and process for purifying phthalonitriles 三菱瓦斯化学株式会社 2024-08-23 CN claimed
US-20230111802-A1 METHOD FOR PRODUCING PURIFIED PHTHALONITRILE AND METHOD FOR PURIFYING PHTHALONITRILE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2023-04-13 US claimed
EP-4112598-A1 METHOD FOR PRODUCING PURIFIED PHTHALONITRILE AND METHOD FOR PURIFYING PHTHALONITRILE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2023-01-04 EP claimed
CN-115175897-A Method for producing purified phthalonitriles and method for purifying phthalonitriles 三菱瓦斯化学株式会社 2022-10-11 CN claimed
CN-107311986-A The carboxylic acids inhibitor of heat shock protein 90 of Tetrahydroisoquinoli- beautiful jade 3 and its application 山东大学 2017-11-03 CN claimed
CN-102285964-B Cyanobenzamide compound and application thereof Sinochem Group 2013-11-27 CN claimed
EP-0989115-A2 Process for producing cyanobenzoic acid derivatives Showa Denko Kabushiki Kaisha (JP) 2000-03-29 EP claimed
CN-1043760-C \"Pyridinecarboximidamide compounds and the use thereof\ KIRN BEER KABUSHIKI KAISHA (JP) 1999-06-23 CN claimed
CN-1041923-C Piperazine derivatives FUJISAWA PHARMACEUTICAL CO (JP) 1999-02-03 CN claimed
CN-1077949-A Pyridine carboxy imido acid amide compound and application thereof KIRIN BREWERY (JP) 1993-11-03 CN claimed
US-4604460-A ANTIBIOTICS, BACTERICIDES SHIONOGI & CO., LTD. (JP) 1986-08-05 US claimed
US-4478997-A 1-Oxadethiacepham compounds SHIONOGI & CO., LTD. (JP) 1984-10-23 US claimed
US-4443598-A ANTIBIOTICS AND INTERMEDIATES SHIONOGI & CO., LTD. (JP) 1984-04-17 US claimed
US-4424331-A Stable, anaerobically-hardening adhesives containing mixed amine oxide/HN-acidic compound initiators HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1984-01-03 US claimed
US-4386194-A ACRYLIC ESTERS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1983-05-31 US claimed
EP-0034708-A2 Anaerobic curing adhesives and sealants Henkel Kommanditgesellschaft auf Aktien (DE) 1981-09-02 EP claimed