SCHEMBL7422364

SCHEMBL7422364

CC[C@@H]1CNc2ccccc2C1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.59
MTNR1B P49286 1/20 0.59
EPHX2 P34913 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
BRD4 O60885 3/20 0.39
CREBBP Q92793 2/20 0.39
ALOX15 P16050 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP19A1 P11511 1/20 0.37
HTR2B P41595 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
DRD3 P35462 1/20 0.34
ADRA2A P08913 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
SCHEMBL7422361 1.00 MTNR1A (0.59) MTNR1AMTNR1BEPHX2MEN1KMT2A
SCHEMBL18576830 0.82 MTNR1A (0.56) MTNR1AMTNR1BEPHX2MEN1KMT2A
SCHEMBL8562575 0.82 MTNR1A (0.52) MTNR1AMTNR1BEPHX2MEN1KMT2A
SCHEMBL8562578 0.82 MTNR1A (0.52) MTNR1AMTNR1BEPHX2MEN1KMT2A
SCHEMBL8562571 0.82 MTNR1A (0.52) MTNR1AMTNR1BEPHX2MEN1KMT2A
SCHEMBL7835228 0.82 MTNR1A (0.52) MTNR1AMTNR1BEPHX2MEN1KMT2A
SCHEMBL16353622 0.81 MTNR1A (0.59) MTNR1AMTNR1BEPHX2MEN1KMT2A
SCHEMBL2036744 0.81 MTNR1A (0.59) MTNR1AMTNR1BEPHX2MEN1KMT2A
SCHEMBL30576519 0.81 MTNR1A (0.55) MTNR1AMTNR1BEPHX2MEN1KMT2A
SCHEMBL8564553 0.81 MTNR1A (0.55) MTNR1AMTNR1BEPHX2MEN1KMT2A

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
EP-0815103-A1 TRYPSIN AND THROMBIN INHIBITORS Novartis AG (CH) 1998-01-07 EP disclosed
WO-1996029327-A1 TRYPSIN AND THROMBIN INHIBITORS NOVARTIS AG (CH) 1996-09-26 WO disclosed