SCHEMBL4827153

SCHEMBL4827153

O=C(O)c1ccc(C2CCCCC2)c(-c2ccccc2)c1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CAMKK2 Q96RR4 16/20 0.46
CAMKK1 Q8N5S9 12/20 0.46
KMO O15229 1/20 0.41
SGK1 O00141 1/20 0.41
AURKA O14965 1/20 0.41
SGK3 Q96BR1 1/20 0.41
SGK2 Q9HBY8 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.40
ACMSD Q8TDX5 1/20 0.40
DHODH Q02127 1/20 0.40

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
SCHEMBL8774870 0.86 PTGDR2 (0.47) CAMKK2CAMKK1KMOPTGDR2ACMSD
SCHEMBL11287717 0.85 CAMKK2 (0.40) CAMKK2CAMKK1SGK1AURKASGK3
SCHEMBL14989258 0.81 ACMSD (0.46) CAMKK2CAMKK1KMOPTGDR2ACMSD
Phthalic Acid SCHEMBL11407238 0.80 PTGDR2 (0.47) CAMKK2CAMKK1KMOPTGDR2ACMSD
SCHEMBL1705927 0.80 KMO (0.46) CAMKK2CAMKK1KMOPTGDR2ACMSD
Phthalic Acid SCHEMBL11409627 0.78 ALDH1A1 (0.47) CAMKK2CAMKK1KMOPTGDR2ACMSD
SCHEMBL11409144 0.78 ACMSD (0.44) CAMKK2CAMKK1KMOPTGDR2ACMSD
SCHEMBL167431 0.78 ACMSD (0.44) CAMKK2CAMKK1KMOPTGDR2ACMSD
SCHEMBL11405090 0.78 ACMSD (0.44) CAMKK2CAMKK1KMOPTGDR2ACMSD
SCHEMBL27865683 0.77 POLB (0.46) KMOPTGDR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7335405-B2 Nematic liquid crystal mixtures for use in bistable display devices NEMOPTIC (FR) 2008-02-26 US disclosed
US-20060249708-A1 Nematic liquid crystal mixtures for use in bistable display devices CDC PROPRIETE INTELLECTUELLE (FR) 2006-11-09 US disclosed