Benzylamine

Benzylamine

SCHEMBL28245162

CCC=NCc1ccccc1.NCc1ccccc1

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 2/20 0.52
TAAR1 Q96RJ0 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NOS2 P35228 5/20 0.39
NOS1 P29475 4/20 0.39
NOS3 P29474 2/20 0.39
CYP3A4 P08684 1/20 0.39
NFKB1 P19838 1/20 0.39
PNMT P11086 1/20 0.38

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
SCHEMBL7118048 0.90 TP53 (0.44) SMN1; SMN2ALDH1A1KDM4EPOLBGAA
SCHEMBL3390354 0.90 TP53 (0.44) SMN1; SMN2ALDH1A1KDM4EPOLBGAA
Benzylamine SCHEMBL28934699 0.75 LOXL2 (0.82) LOXL2TAAR1SMN1; SMN2PNMTMAOB
Benzylamine SCHEMBL6991195 0.75 LOXL2 (0.82) LOXL2TAAR1SMN1; SMN2PNMTMAOB
SCHEMBL4614050 0.75 TP53 (0.41) SMN1; SMN2ALDH1A1KDM4EPOLBGAA
SCHEMBL4613220 0.75 TP53 (0.41) SMN1; SMN2ALDH1A1KDM4EPOLBGAA
Benzylamine SCHEMBL28763952 0.74 LOXL2 (0.64) LOXL2TAAR1SMN1; SMN2NOS2NOS1
Benzylamine SCHEMBL28132187 0.74 LOXL2 (0.64) LOXL2TAAR1SMN1; SMN2ALDH1A1TDP1
Benzylamine SCHEMBL9494893 0.73 LOXL2 (0.78) LOXL2TAAR1SMN1; SMN2PNMTMAOB
Benzylamine SCHEMBL27904613 0.73 LOXL2 (0.78) LOXL2TAAR1SMN1; SMN2KDM4EMAPT

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-106748877-B The method that one-step method prepares propylidene benzylamine 江苏扬农化工集团有限公司 2018-10-16 CN disclosed