SCHEMBL7654098

SCHEMBL7654098

Cc1nccc(N2CCC(O)(CN3CCN(C(=O)c4ccc(F)cc4)CC3)CC2)n1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
USP7 Q93009 2/20 0.44
SLC6A7 Q99884 1/20 0.43
KDM4E B2RXH2 2/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LDHA P00338 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
IDH1 O75874 1/20 0.41

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
SCHEMBL7662050 0.81 HTR2A (0.47) L3MBTL1SLC6A7KDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL7654158 0.76 HRH4 (0.44) MEN1KMT2AALDH1A1MAPK1HSD17B10
SCHEMBL8311501 0.75 LSS (0.55) L3MBTL1SLC6A7KDM4EMEN1KMT2A
SCHEMBL7655661 0.75 LSS (0.48) KDM4EKMT2A
SCHEMBL9513674 0.74 KDM4E (0.59) L3MBTL1SLC6A7KDM4EALDH1A1MAPK1
SCHEMBL7658281 0.72 LSS (0.47) L3MBTL1KDM4EMEN1KMT2AALDH1A1
SCHEMBL13392116 0.70 GRM5 (0.52) USP7MEN1KMT2ALMNAMAPT
SCHEMBL6980429 0.69 SLC6A7 (0.56) L3MBTL1SLC6A7KDM4EALDH1A1MAPK1
SCHEMBL9514848 0.68 ALDH1A1 (0.64) KDM4EMEN1KMT2AALDH1A1MAPT
SCHEMBL8118309 0.67 L3MBTL1 (0.41) L3MBTL1SLC6A7SMN1; SMN2

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-6335341-B1 ANTICHOLESTEROL AGENTS; ATHEROSCLEROSIS ZENECA LIMITED (GB) 2002-01-01 US disclosed