SCHEMBL9623296

SCHEMBL9623296

CCC(CC)CNC(=O)Oc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.51
NPC1 O15118 2/20 0.51
CYP1A2 P05177 1/20 0.50
HSD17B10 Q99714 1/20 0.48
ALDH1A1 P00352 4/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 1/20 0.47
MIF P14174 1/20 0.47
FAAH O00519 1/20 0.47
GAA P10253 2/20 0.47
TAAR1 Q96RJ0 1/20 0.47
PRMT5 O14744 2/20 0.46
WDR77 Q9BQA1 1/20 0.46
MAPT P10636 2/20 0.46
THRB P10828 1/20 0.46
HPGD P15428 1/20 0.46
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44

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
SCHEMBL27356751 0.83 NPC1 (0.57) RAB9ANPC1CYP1A2HSD17B10ALDH1A1
SCHEMBL10664573 0.83 NPC1 (0.57) RAB9ANPC1CYP1A2HSD17B10ALDH1A1
SCHEMBL28335634 0.83 MEN1 (0.50) RAB9ANPC1CYP1A2HSD17B10ALDH1A1
SCHEMBL23766625 0.81 NPC1 (0.56) RAB9ANPC1CYP1A2HSD17B10ALDH1A1
SCHEMBL23766641 0.81 PRMT5 (0.59) RAB9ANPC1HSD17B10ALDH1A1MEN1
SCHEMBL126140 0.80 HSD17B10 (0.54) RAB9ANPC1CYP1A2HSD17B10ALDH1A1
SCHEMBL14338246 0.80 CYP1A2 (0.58) RAB9ANPC1CYP1A2HSD17B10ALDH1A1
SCHEMBL2396325 0.80 NPC1 (0.51) RAB9ANPC1CYP1A2HSD17B10ALDH1A1
SCHEMBL13387473 0.80 MGLL (0.52) ALDH1A1KMT2A
SCHEMBL28897234 0.79 RAB9A (0.50) RAB9ANPC1HSD17B10ALDH1A1MEN1

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-0300691-B1 PLANT-PROTECTIVE COMPOSITION CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1992-03-04 EP claimed