SCHEMBL18686285

SCHEMBL18686285

CCCCCNC(=O)N(CCCCC)CCCCC

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 10/20 0.54
CASP2 P42575 1/20 0.48
EPHX2 P34913 2/20 0.48
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46
NAAA Q02083 1/20 0.46
DNM1 Q05193 1/20 0.44
DPP7 Q9UHL4 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA9 Q16790 1/20 0.42
FAAH O00519 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
SCHEMBL25277945 0.98 EPHX1 (0.57) EPHX1CASP2EPHX2ZDHHC20ZDHHC2
SCHEMBL25271038 0.98 EPHX1 (0.57) EPHX1CASP2EPHX2ZDHHC20ZDHHC2
SCHEMBL25226253 0.98 EPHX1 (0.57) EPHX1CASP2EPHX2ZDHHC20ZDHHC2
SCHEMBL25271043 0.98 EPHX1 (0.57) EPHX1CASP2EPHX2ZDHHC20ZDHHC2
SCHEMBL25278342 0.98 EPHX1 (0.57) EPHX1CASP2EPHX2ZDHHC20ZDHHC2
SCHEMBL25277668 0.98 EPHX1 (0.57) EPHX1CASP2EPHX2ZDHHC20ZDHHC2
SCHEMBL25276958 0.98 EPHX1 (0.57) EPHX1CASP2EPHX2ZDHHC20ZDHHC2
SCHEMBL25227053 0.98 EPHX1 (0.57) EPHX1CASP2EPHX2ZDHHC20ZDHHC2
SCHEMBL25224598 0.98 EPHX1 (0.57) EPHX1CASP2EPHX2ZDHHC20ZDHHC2
SCHEMBL25230059 0.98 EPHX1 (0.57) EPHX1CASP2EPHX2ZDHHC20ZDHHC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1862198-B1 Brightening and/or dyeing agent with urea derivatives HENKEL AG & CO KGAA (DE) 2017-04-05 EP claimed
EP-4446310-A1 METHOD FOR PRODUCING BLOCKED ISOCYANATE COMPOUND AND METHOD FOR PRODUCING ISOCYANATE COMPOUND Asahi Kasei Kabushiki Kaisha (JP) 2024-10-16 EP disclosed
CN-118382612-A Method for producing blocked isocyanate compound and method for producing isocyanate compound 旭化成株式会社 2024-07-23 CN disclosed
WO-2023106377-A1 METHOD FOR PRODUCING BLOCKED ISOCYANATE COMPOUND AND METHOD FOR PRODUCING ISOCYANATE COMPOUND 旭化成株式会社 2023-06-15 WO disclosed