SCHEMBL27415380

SCHEMBL27415380

CCCCC(CC)N(N)c1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.37
GAA P10253 1/20 0.37
ALOX12 P18054 1/20 0.37
CRHBP P24387 1/20 0.37
HTT P42858 1/20 0.37
CRHR2 Q13324 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
AOC3 Q16853 3/20 0.36
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 1/20 0.36
CSNK1E P49674 1/20 0.34
CNR2 P34972 1/20 0.34
MEN1 O00255 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
POLB P06746 1/20 0.33
CA2 P00918 1/20 0.33
NPC1 O15118 1/20 0.33
JAK2 O60674 1/20 0.33

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
SCHEMBL29139129 0.83 CSNK1E (0.42) NPSR1AOC3ALDH1A1CSNK1ECNR2
SCHEMBL28501660 0.80 MAPT (0.38) MAPTGAAALOX12CRHBPHTT
SCHEMBL14541283 0.79 MAPT (0.41) MAPTGAAALOX12CRHBPHTT
SCHEMBL8436010 0.77 TDP1 (0.38) MAPTGAAALOX12CRHBPHTT
SCHEMBL28077204 0.75 CSNK1E (0.41) MAPTGAAALOX12CRHBPHTT
SCHEMBL20015614 0.75 CYP2C19 (0.39) MAPTGAAALOX12CRHBPHTT
SCHEMBL6681306 0.74 SIGMAR1 (0.42) MAPTGAAALOX12CRHBPHTT
SCHEMBL17440484 0.73 SIGMAR1 (0.44) NPSR1ALDH1A1CSNK1ECNR2MEN1
SCHEMBL886842 0.73 SIGMAR1 (0.44) NPSR1ALDH1A1CSNK1ECNR2MEN1
SCHEMBL6478164 0.72 ALDH1A1 (0.47) MAPTGAAHTTAOC3ALDH1A1

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
CN-1117754-C Indolomorphinane derivatives and remedies/preventives for cerebral disorders TORAY INDUSTRIES (JP) 2003-08-13 CN disclosed
CN-1220668-A INDOLOMORPHINANE DERIVATIVES AND REMEDIES/PREVENTIVES FOR CEREBRAL DISORDERS TORAY INDUSTRIES (JP) 1999-06-23 CN disclosed