SCHEMBL19741476

SCHEMBL19741476

CCCCCCCCCCCCSNC(=O)NCCCCCC

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 18/20 0.64
CASP2 P42575 1/20 0.48
EPHX2 P34913 2/20 0.46
ALDH1A1 P00352 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL5454992 0.89 EPHX1 (0.60) EPHX1CASP2EPHX2ALDH1A1HTT
SCHEMBL9665506 0.87 FAAH (0.47) EPHX1CASP2
SCHEMBL1276540 0.86 CES2 (0.47) EPHX1ALDH1A1
SCHEMBL9666789 0.81 EPHX1 (0.69) EPHX1CASP2EPHX2ALDH1A1HTT
SCHEMBL11527896 0.80 EPHX1 (0.50) EPHX1HTT
SCHEMBL25277850 0.80 EPHX1 (1.00) EPHX1CASP2EPHX2
SCHEMBL25225212 0.80 EPHX1 (1.00) EPHX1CASP2EPHX2
SCHEMBL25271304 0.80 EPHX1 (1.00) EPHX1CASP2EPHX2
SCHEMBL25278283 0.80 EPHX1 (1.00) EPHX1CASP2EPHX2
SCHEMBL25271007 0.80 EPHX1 (1.00) EPHX1CASP2EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10767112-B2 Methods of producing metal sulfides, metal selenides, and metal sulfides/selenides having controlled architectures using kinetic control THE TRUSTEES OF THE COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2020-09-08 US disclosed
US-20170369779-A1 METHODS OF PRODUCING METAL SULFIDES, METAL SELENIDES, AND METAL SULFIDES/SELENIDES HAVING CONTROLLED ARCHITECTURES USING KINETIC CONTROL THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2017-12-28 US disclosed