SCHEMBL9876351

SCHEMBL9876351

Cc1ccc(-c2ccc3ccc(C(C)C)ccc2-3)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 1/20 0.42
ERN1 O75460 1/20 0.40
ACHE P22303 2/20 0.40
BCHE P06276 1/20 0.40
CHRNA7 P36544 1/20 0.39
MAPT P10636 4/20 0.39
TP53 P04637 2/20 0.39
GAA P10253 1/20 0.39
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
NOTUM Q6P988 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
TYR P14679 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
USP2 O75604 1/20 0.38
KMT2A Q03164 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
SCHEMBL1132573 0.87 KIF11 (0.45) LMNAACHEBCHECHRNA7MAPT
SCHEMBL26046612 0.87 AKR1C3 (0.42) LMNAAKR1C3AKR1C2ERN1ACHE
Iodide SCHEMBL30804631 0.85 KIF11 (0.44) LMNAACHEBCHECHRNA7MAPT
Iodide SCHEMBL28367770 0.85 KIF11 (0.44) LMNAACHEBCHECHRNA7MAPT
P-Cymene SCHEMBL1143 0.84 ACHE (0.53) LMNAACHEBCHECHRNA7TDP1
P-Cymene SCHEMBL1697748 0.84 ACHE (0.53) LMNAACHEBCHECHRNA7TDP1
P-Cymene SCHEMBL3684076 0.82 ACHE (0.50) LMNAACHEBCHECHRNA7TDP1
P-Cymene SCHEMBL31300110 0.82 ACHE (0.50) LMNAACHEBCHECHRNA7TDP1
P-Cymene SCHEMBL13735610 0.82 ACHE (0.50) LMNAACHEBCHECHRNA7TDP1
P-Cymene SCHEMBL30953569 0.82 ACHE (0.50) LMNAACHEBCHECHRNA7TDP1

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-5037575-A Photostability MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1991-08-06 US disclosed