SCHEMBL9640359

SCHEMBL9640359

NC(=O)NCC1(c2ccccc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.59
L3MBTL1 Q9Y468 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
NPSR1 Q6W5P4 2/20 0.58
CNR1 P21554 1/20 0.57
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
HSD17B10 Q99714 1/20 0.54
ALDH1A1 P00352 5/20 0.52
POLB P06746 1/20 0.52
MAPK1 P28482 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C19 P33261 1/20 0.52
KDM4E B2RXH2 1/20 0.51
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
NPFFR1 Q9GZQ6 1/20 0.49
NPFFR2 Q9Y5X5 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL3984004 0.93 LMNA (0.69) LMNAL3MBTL1SMN1; SMN2NPSR1MEN1
SCHEMBL9640407 0.92 LMNA (0.68) LMNAL3MBTL1SMN1; SMN2NPSR1MEN1
SCHEMBL20960413 0.89 ALDH1A1 (0.64) LMNAL3MBTL1SMN1; SMN2NPSR1ALDH1A1
SCHEMBL13685127 0.82 LMNA (0.51) LMNAL3MBTL1SMN1; SMN2NPSR1CNR1
SCHEMBL23195319 0.82 CYP3A4 (0.60) LMNAL3MBTL1SMN1; SMN2NPSR1CNR1
SCHEMBL31562848 0.79 MEN1 (0.58) LMNAL3MBTL1SMN1; SMN2NPSR1CNR1
SCHEMBL10083664 0.75 LMNA (1.00) LMNAL3MBTL1SMN1; SMN2NPSR1MEN1
SCHEMBL21111717 0.75 KCNA3 (0.64) LMNAL3MBTL1SMN1; SMN2NPSR1CNR1
SCHEMBL5568764 0.75 LMNA (0.55) LMNAL3MBTL1SMN1; SMN2NPSR1CNR1
SCHEMBL3373766 0.75 LMNA (0.68) LMNAL3MBTL1SMN1; SMN2NPSR1MEN1

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-0293880-B1 ANTIHYPERLIPIDEMIC AND ANTIATHEROSCLEROTIC UREA COMPOUNDS WARNER-LAMBERT COMPANY (US) 1992-08-26 EP claimed
EP-0293880-B1 ANTIHYPERLIPIDEMIC AND ANTIATHEROSCLEROTIC UREA COMPOUNDS WARNER-LAMBERT COMPANY (US) 1992-08-26 EP disclosed