SCHEMBL7428109

SCHEMBL7428109

Cc1ccc(NC(=O)N2CCC(NCC(O)C3COc4ccccc4O3)CC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
RAB9A P51151 4/20 0.50
POLB P06746 1/20 0.48
ALOX15 P16050 1/20 0.48
FAAH O00519 1/20 0.48
NPC1 O15118 3/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
TDP1 Q9NUW8 2/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
TSHR P16473 2/20 0.44
IDO1 P14902 1/20 0.44
TDO2 P48775 1/20 0.44
KMT2A Q03164 3/20 0.43
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTT P42858 1/20 0.41
MEN1 O00255 1/20 0.41
GLA P06280 1/20 0.41
MAPT P10636 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
SCHEMBL7431708 0.92 FAAH (0.45) LMNAFAAHNPSR1TSHRSMN1; SMN2
SCHEMBL7434127 0.91 ALOX5 (0.47) LMNARAB9APOLBFAAHNPC1
SCHEMBL7438986 0.90 SMN1; SMN2 (0.50) LMNARAB9AFAAHNPC1L3MBTL1
SCHEMBL7447128 0.88 RAB9A (0.52) LMNARAB9APOLBNPC1L3MBTL1
SCHEMBL7435658 0.88 CNR2 (0.44) LMNARAB9APOLBNPC1KMT2A
SCHEMBL7444281 0.87 NAMPT (0.46) LMNAPOLBFAAHKMT2ASMN1; SMN2
SCHEMBL7440356 0.87 POLB (0.43) LMNARAB9APOLBALOX15NPSR1
SCHEMBL7438480 0.87 LMNA (0.44) LMNARAB9ANPC1L3MBTL1NPSR1
SCHEMBL7431884 0.85 LMNA (0.48) LMNAPOLBNPC1NPSR1KMT2A
SCHEMBL7437962 0.84 POLB (0.47) LMNAPOLBNPC1L3MBTL1TSHR

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-4499100-A CARDIOUVASCULAR DISORDERS SYNTEX (U.S.A.) INC. (US) 1985-02-12 US disclosed