SCHEMBL9498396

SCHEMBL9498396

CCc1cnc(-c2ccccc2C(O)CC)nc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
USP1 O94782 13/20 0.38
WDR48 Q8TAF3 10/20 0.38
IDO1 P14902 1/20 0.35
PIP4K2C Q8TBX8 1/20 0.34
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 2/20 0.33
ROCK2 O75116 1/20 0.32
ROCK1 Q13464 1/20 0.32

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
SCHEMBL9500363 0.88 SMN1; SMN2 (0.38) LMNAUSP1WDR48PIP4K2CNPC1
SCHEMBL9500599 0.86 LMNA (0.39) LMNAUSP1WDR48PIP4K2CTSHR
SCHEMBL9498428 0.85 RARB (0.40) LMNAUSP1WDR48NPC1ALDH1A1
SCHEMBL9499138 0.84 RARB (0.45) LMNAUSP1WDR48NPC1ALDH1A1
SCHEMBL9498708 0.83 RARB (0.47) LMNANPC1ALDH1A1MAPTRAB9A
SCHEMBL9500275 0.83 RARB (0.47) LMNANPC1ALDH1A1MAPTRAB9A
SCHEMBL9498197 0.83 RARB (0.47) LMNANPC1ALDH1A1MAPTRAB9A
SCHEMBL9498424 0.83 RARB (0.47) LMNANPC1ALDH1A1MAPTRAB9A
SCHEMBL9502051 0.83 RARB (0.47) LMNANPC1ALDH1A1MAPTRAB9A
SCHEMBL9498391 0.83 LMNA (0.37) LMNAUSP1WDR48NPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0354655-B1 1-PHENYL-1-PROPANOL DERIVATIVES CHISSO CORPORATION (JP) 1993-04-07 EP disclosed
US-5076947-A Optically active; free from temperature dependence CHISSO CORPORATION (JP) 1991-12-31 US disclosed
EP-0354655-A2 1-Phenyl-1-propanol derivatives CHISSO CORPORATION (JP) 1990-02-14 EP disclosed