SCHEMBL28039769

SCHEMBL28039769

O/C=C/Cc1ccc(Br)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 4/20 0.43
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TAAR1 Q96RJ0 3/20 0.39
HTR2A P28223 1/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
ARG2 P78540 1/20 0.39
MAOB P27338 1/20 0.39
CYP2A6 P11509 1/20 0.38
TGM2 P21980 1/20 0.37
TSHR P16473 1/20 0.37
ALOX15 P16050 1/20 0.36
GPR52 Q9Y2T5 1/20 0.36

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
SCHEMBL3255735 1.00 IDO1 (0.43) IDO1MEN1KMT2ATAAR1HTR2A
SCHEMBL24042960 1.00 IDO1 (0.43) IDO1MEN1KMT2ATAAR1HTR2A
SCHEMBL27484994 0.80 IDO1 (0.45) IDO1MEN1KMT2ATAAR1HTR2A
SCHEMBL28760384 0.79 MAOB (0.42) IDO1MEN1KMT2ATAAR1HTR2A
SCHEMBL28224562 0.78 IDO1 (0.44) IDO1MEN1KMT2ATAAR1HTR2A
SCHEMBL27614866 0.78 ESR1 (0.48) IDO1MEN1KMT2ATAAR1CA1
SCHEMBL1805094 0.78 ESR1 (0.48) IDO1MEN1KMT2ATAAR1CA1
SCHEMBL28743524 0.78 IDO1 (0.44) IDO1MEN1KMT2ATAAR1HTR2A
SCHEMBL3642598 0.76 IDO1 (0.48) IDO1MEN1KMT2ATAAR1HTR2A
SCHEMBL6404439 0.76 ALDH1A1 (0.46) MEN1KMT2ACA1CA2ARG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109734620-A A kind of preparation method of N-1,5- diaryl -4- amylene -1- acetamide compound 大连理工大学 2019-05-10 CN disclosed
CN-105073710-B Novel hydroxamic acid derivative or salt thereof 富山化学工业株式会社 2018-02-16 CN disclosed
CN-105073710-A Novel hydroxamic acid derivative or salt thereof TOYAMA CHEMICAL CO LTD 2015-11-18 CN disclosed