SCHEMBL9601408

SCHEMBL9601408

CCN1C2CCC1CC(NC(=O)ON1CCc3ccccc31)C2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.48
KMT2A Q03164 2/20 0.48
TSHR P16473 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.48
HTR4 Q13639 1/20 0.42
ALDH1A1 P00352 1/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HPGD P15428 1/20 0.40
DRD2 P14416 2/20 0.39
NR1I3 Q14994 1/20 0.39
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
USP2 O75604 1/20 0.38
NOTUM Q6P988 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 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
SCHEMBL9602248 0.87 MEN1 (0.43) SMN1; SMN2KMT2ATSHRNPSR1MEN1
SCHEMBL9602370 0.83 SMN1; SMN2 (0.48) SMN1; SMN2KMT2ATSHRNPSR1MEN1
SCHEMBL7272509 0.82 SMN1; SMN2 (0.62) SMN1; SMN2KMT2ATSHRNPSR1MEN1
SCHEMBL9601571 0.72 MEN1 (0.51) KMT2AMEN1HTR4CYP2D6CYP2C19
SCHEMBL9601933 0.72 HTR3A (0.45) KMT2AMEN1NOTUM
SCHEMBL9602854 0.71 CHRNA7 (0.50)
SCHEMBL27822313 0.71 ALDH1A1 (0.47) SMN1; SMN2KMT2ATSHRMEN1POLB
SCHEMBL9602598 0.70 DRD2 (0.46) SMN1; SMN2POLBALDH1A1NPC1RAB9A
SCHEMBL27761216 0.69 NOTUM (0.57) SMN1; SMN2KMT2ATSHRMEN1POLB
SCHEMBL7266518 0.68 SMN1; SMN2 (0.67) SMN1; SMN2KMT2ATSHRNPSR1MEN1

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
EP-0247266-B1 INDOLE DERIVATIVES HAVING AN AZABICYCLIC SIDE CHAIN, PROCESS FOR THEIR PREPARATION, INTERMEDIATES, AND PHARMACEUTICAL COMPOSITIONS BEECHAM GROUP PLC (GB) 1993-03-10 EP claimed