SCHEMBL9735488

SCHEMBL9735488

Cc1ccc(/C=C/C(=O)N2CCN(C(=O)C3CCC(=O)N3)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.59
HPGD P15428 3/20 0.51
ALDH1A1 P00352 2/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
GPR183 P32249 8/20 0.50
LMNA P02545 4/20 0.50
KDM4E B2RXH2 1/20 0.50
KCNH2 Q12809 1/20 0.46
TP53 P04637 2/20 0.44
THRB P10828 1/20 0.44
GAA P10253 2/20 0.44
POLB P06746 1/20 0.43

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
SCHEMBL9735480 1.00 MAPT (0.59) MAPTHPGDALDH1A1NPC1RAB9A
SCHEMBL9735594 0.88 MEN1 (0.57) MAPTHPGDNPC1RAB9ASMN1; SMN2
SCHEMBL9735590 0.88 MEN1 (0.57) MAPTHPGDNPC1RAB9ASMN1; SMN2
SCHEMBL9735192 0.88 GPR183 (0.58) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL9735198 0.88 GPR183 (0.58) MAPTALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL9735965 0.79 PKM (0.51) HPGDALDH1A1LMNA
SCHEMBL7950882 0.76 NAMPT (0.51) ALDH1A1SMN1; SMN2POLB
SCHEMBL7950888 0.76 NAMPT (0.51) ALDH1A1SMN1; SMN2POLB
SCHEMBL8824257 0.76 L3MBTL1 (0.62) MAPTALDH1A1SMN1; SMN2GPR183LMNA
SCHEMBL11479548 0.74 MAPT (0.74) MAPTHPGDALDH1A1NPC1RAB9A

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
US-5102882-A Nootropic agents NIPPON SHINYAKU CO., LTD. (JP) 1992-04-07 US disclosed