SCHEMBL28816253

SCHEMBL28816253

C[CH]OCCCCCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 8/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
IDO1 P14902 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
MAOA P21397 1/20 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
SCHEMBL27996561 0.98 IDO1 (0.48) SIGMAR1L3MBTL1TDP1IDO1MEN1
SCHEMBL1720772 0.92 IDO1 (0.55) SIGMAR1L3MBTL1IDO1MEN1KMT2A
SCHEMBL450596 0.84 CA1 (0.44) SIGMAR1TDP1IDO1MEN1KMT2A
SCHEMBL97332 0.81 SIGMAR1 (0.52) SIGMAR1IDO1
SCHEMBL96962 0.81 SIGMAR1 (0.52) SIGMAR1IDO1
SCHEMBL2517 0.78 SIGMAR1 (0.48) SIGMAR1IDO1MAOA
SCHEMBL7590883 0.78 IDO1 (0.48) SIGMAR1L3MBTL1TDP1IDO1MAOA
SCHEMBL8499231 0.78 L3MBTL1 (0.57) SIGMAR1L3MBTL1TDP1IDO1MAOA
SCHEMBL8498124 0.78 L3MBTL1 (0.57) SIGMAR1L3MBTL1TDP1IDO1MAOA
SCHEMBL8499737 0.78 L3MBTL1 (0.57) SIGMAR1L3MBTL1TDP1IDO1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104302644-A Thiazolecarboxamide derivatives and methods of use thereof NIHON NOHYAKU CO LTD 2015-01-21 CN disclosed