SCHEMBL10364646

SCHEMBL10364646

CC(=O)NCCn1ccnc1C

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 6/20 0.54
KMT2A Q03164 2/20 0.50
ALDH1A1 P00352 2/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
POLB P06746 1/20 0.50
MAPK1 P28482 1/20 0.48
NAMPT P43490 1/20 0.47
MTNR1B P49286 4/20 0.45
TSHR P16473 1/20 0.43
FDPS P14324 1/20 0.43
NOS1 P29475 1/20 0.43
KDM4E B2RXH2 1/20 0.42
TP53 P04637 1/20 0.42

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
SCHEMBL3038961 0.88 ALDH1A1 (0.51) MTNR1AKMT2AALDH1A1CA12CA1
SCHEMBL812138 0.88 ALDH1A1 (0.51) MTNR1AKMT2AALDH1A1CA12CA1
SCHEMBL811127 0.85 CA12 (0.52) MTNR1AKMT2AALDH1A1CA12CA1
SCHEMBL17355067 0.84 KMT2A (0.51) MTNR1AKMT2AALDH1A1CA12CA1
SCHEMBL8131223 0.83 ALDH1A1 (0.54) KMT2AALDH1A1CA12CA1CA2
SCHEMBL811674 0.83 KMT2A (0.53) MTNR1AKMT2AALDH1A1CA12CA1
SCHEMBL12304473 0.83 CYP1A2 (0.51) KMT2AALDH1A1CA12CA1CA2
SCHEMBL22588365 0.79 KMT2A (0.44) KMT2AALDH1A1CA12CA1CA2
SCHEMBL5077958 0.79 CA12 (0.49) KMT2AALDH1A1CA12CA1CA2
SCHEMBL3051709 0.79 CA12 (0.60) KMT2AALDH1A1CA12CA1CA2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0239246-B1 NOVEL IMIDAZOLE COMPOUNDS, PROCESS FOR SYNTHESIS THEREOF, AND METHOD OF CURING EPOXY RESINS USING SAID COMPOUNDS SHIKOKU CHEMICALS CORPORATION (JP) 1990-05-16 EP claimed
EP-0239246-A1 Novel imidazole compounds, process for synthesis thereof, and method of curing epoxy resins using said compounds SHIKOKU CHEMICALS CORPORATION (JP) 1987-09-30 EP claimed
JP-62198668-A None JP disclosed
US-11697761-B2 Compositions and methods for corrosion inhibitor monitoring CHAMPIONX USA INC. (US) 2023-07-11 US disclosed
US-20210163818-A1 COMPOSITIONS AND METHODS FOR CORROSION INHIBITOR MONITORING APERGY ESP SYSTEMS, LLC 2021-06-03 US disclosed
EP-0239246-B1 NOVEL IMIDAZOLE COMPOUNDS, PROCESS FOR SYNTHESIS THEREOF, AND METHOD OF CURING EPOXY RESINS USING SAID COMPOUNDS SHIKOKU CHEMICALS CORPORATION (JP) 1990-05-16 EP disclosed
US-4826991-A Production of 1-aminoethyl-imidazoles via the hydrolysis of 1-acylaminoethylimidazoles SHIKOKU CHEMICALS CORPORATION (JP) 1989-05-02 US disclosed
EP-0239246-A1 Novel imidazole compounds, process for synthesis thereof, and method of curing epoxy resins using said compounds SHIKOKU CHEMICALS CORPORATION (JP) 1987-09-30 EP disclosed
JP-S62198668-A NOVEL IMIDAZOLE COMPOUND, SYNTHESIS THEREOF AND CURING OF POLYEPOXY RESIN USING SAID COMPOUND SHIKOKU CHEM CORP 1987-09-02 JP disclosed