SCHEMBL24650478

SCHEMBL24650478

CCOC(=O)COC1c2ccccc2CC1N

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
MAPT P10636 4/20 0.38
ALDH1A1 P00352 3/20 0.38
ATM Q13315 2/20 0.38
USP2 O75604 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CYP1A2 P05177 1/20 0.38
GAA P10253 2/20 0.37
TSHR P16473 2/20 0.37
NOTUM Q6P988 1/20 0.36
MAPK1 P28482 1/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL24650457 0.87 NOTUM (0.40) POLBMAPTALDH1A1ATML3MBTL1
SCHEMBL24650474 0.86 PYGL (0.38)
SCHEMBL24650473 0.85 NAMPT (0.41) POLBALDH1A1CYP1A2NOTUMSMN1; SMN2
SCHEMBL24650332 0.84 HSD17B1 (0.40)
SCHEMBL24650330 0.84 HSD17B1 (0.36)
SCHEMBL24650331 0.82 CA12 (0.40) USP2GAAKDM4ESMN1; SMN2HSD17B10
SCHEMBL24650472 0.82 PYGL (0.44) MAPTCYP1A2GAATSHRMAPK1
SCHEMBL24650334 0.82 OPRM1 (0.39) ALDH1A1GAAKDM4EHSD17B10
SCHEMBL24650346 0.82 GAA (0.42) POLBMAPTALDH1A1L3MBTL1CYP1A2
SCHEMBL20678730 0.81 KDM1A (0.40)

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
WO-2022238507-A1 THERAPEUTIC AMINOINDANE COMPOUNDS AND COMPOSITIONS AWAKN LS EUROPE HOLDINGS LIMITED (IE) 2022-11-17 WO disclosed