SCHEMBL28018043

SCHEMBL28018043

CC(N)(C=C(c1ccccc1)c1ccccc1)CN

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.41
SLC6A2 P23975 2/20 0.36
MTNR1A P48039 1/20 0.36
MTNR1B P49286 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
PRMT1 Q99873 1/20 0.35
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
CYP2C19 P33261 1/20 0.33
TBXAS1 P24557 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
SCHEMBL28288711 0.74 ALDH1A1 (0.39) MTNR1AMTNR1BCYP1A2CYP2C19
SCHEMBL28220158 0.71 CES1 (0.41) MTNR1AMTNR1BCYP1A2CYP2C19
SCHEMBL28507906 0.69 ALDH1A1 (0.39) CYP1A2CYP3A4CYP2C19
SCHEMBL27985687 0.69 HDAC1 (0.39) MTNR1AMTNR1BCYP1A2CYP2D6HDAC1
SCHEMBL27723868 0.69 CYP1B1 (0.40) TAAR1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL1286537 0.66 CHRNB2 (0.47) MTNR1AMTNR1BHDAC1HDAC2
SCHEMBL6509810 0.66 CES1 (0.44) MTNR1AMTNR1BCYP1A2CYP2C19
SCHEMBL19890716 0.65 MAPT (0.37) TAAR1SLC6A2CYP1A2CYP3A4CYP2D6
SCHEMBL4585844 0.64 RAB9A (0.39) MTNR1AMTNR1BCYP1A2CYP3A4CYP2D6
SCHEMBL12192360 0.64 TAAR1 (0.43) TAAR1SLC6A2SLC6A4SLC6A3CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104693065-B Compound 1-(diphenylmethylene) amino-2-amino-2-methyl propane and its preparation method and application 山东百诺医药股份有限公司 2016-07-13 CN claimed
CN-104693065-A New compound 1-(diphenyl methylene) amino-2-amino-2-methylmethane, preparation method and application thereof in Anagliptin synthesis JINAN BESTCOMM PHARMACEUTICAL R & D CO LTD 2015-06-10 CN claimed
CN-104693065-B Compound 1-(diphenylmethylene) amino-2-amino-2-methyl propane and its preparation method and application 山东百诺医药股份有限公司 2016-07-13 CN disclosed
CN-104693065-B Compound 1-(diphenylmethylene) amino-2-amino-2-methyl propane and its preparation method and application 山东百诺医药股份有限公司 2016-07-13 CN disclosed
CN-104693065-A New compound 1-(diphenyl methylene) amino-2-amino-2-methylmethane, preparation method and application thereof in Anagliptin synthesis JINAN BESTCOMM PHARMACEUTICAL R & D CO LTD 2015-06-10 CN disclosed