SCHEMBL19254961

SCHEMBL19254961

CCCC(C)(CC)c1cccc(C(C)=O)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.45
ACHE P22303 3/20 0.43
HPGD P15428 4/20 0.41
ALDH1A1 P00352 2/20 0.41
POLB P06746 1/20 0.41
TAS1R3 Q7RTX0 2/20 0.41
TAS1R1 Q7RTX1 2/20 0.41
MAOB P27338 1/20 0.40
LMNA P02545 2/20 0.40
RAB9A P51151 1/20 0.40
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL19254595 0.84 LOXL2 (0.47) ACHEALDH1A1POLBTAS1R3TAS1R1
SCHEMBL3433869 0.80 KIF11 (0.49) KIF11ACHEHPGDALDH1A1POLB
SCHEMBL309330 0.76 ACHE (0.65) KIF11ACHEALDH1A1
SCHEMBL19261303 0.76 PARP1 (0.50) KIF11ACHEALDH1A1POLBMAPT
SCHEMBL548539 0.74 ACHE (0.53) KIF11ACHEALDH1A1MAOBLMNA
SCHEMBL24377249 0.73 ALDH1A1 (0.42) KIF11ALDH1A1POLBTAS1R3TAS1R1
SCHEMBL18994837 0.73 CA1 (0.41) KIF11ALDH1A1GAASMN1; SMN2MAPT
SCHEMBL22024010 0.73 KCNN4 (0.40) KIF11ACHE
SCHEMBL19483142 0.73 SCN5A (0.44) KIF11
SCHEMBL19728363 0.73 TSHR (0.46) ALDH1A1MAOBRAB9AMAPT

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-9732078-B2 Therapeutic use of imidazopyridine derivatives SANOFI (FR) 2017-08-15 US disclosed