SCHEMBL9202154

SCHEMBL9202154

CN(C)C(=O)c1ccc(C(=O)C(=Cc2ccccc2)OC(C)(C)C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
HPGD P15428 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KIF11 P52732 1/20 0.39
KMT2A Q03164 4/20 0.38
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
USP30 Q70CQ3 1/20 0.37
RAB9A P51151 1/20 0.37
MEN1 O00255 3/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
HIF1A Q16665 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
PDK2 Q15119 2/20 0.36
AKR1C3 P42330 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
SCHEMBL9199128 0.86 HSD17B2 (0.40) ALDH1A1HPGDSMN1; SMN2MAPTLMNA
SCHEMBL9198805 0.85 EPHX2 (0.38) ALDH1A1HPGDSMN1; SMN2KIF11KMT2A
SCHEMBL9207327 0.84 ALDH1A1 (0.45) ALDH1A1HPGDSMN1; SMN2KMT2AMAPT
SCHEMBL9198641 0.81 NR1H4 (0.36) ALDH1A1HPGDSMN1; SMN2KMT2AMAPT
SCHEMBL9203895 0.81 MEN1 (0.51) ALDH1A1HPGDSMN1; SMN2KIF11KMT2A
SCHEMBL9204169 0.81 ALDH1A1 (0.41) ALDH1A1HPGDSMN1; SMN2KIF11KMT2A
SCHEMBL9206935 0.80 SLC7A5 (0.35) ALDH1A1HPGDSMN1; SMN2KMT2AMEN1
SCHEMBL9204754 0.78 LMNA (0.44) ALDH1A1HPGDSMN1; SMN2KIF11KMT2A
SCHEMBL7615069 0.77 AKR1C3 (0.50) ALDH1A1KMT2AMEN1TP53CYP3A4
SCHEMBL9203802 0.76 BCHE (0.41) ALDH1A1HPGDSMN1; SMN2KMT2ALMNA

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
EP-0634927-A1 TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA STATENS SERUMINSTITUT (DK) 1995-01-25 EP disclosed
WO-1993017671-A1 TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA STATENS SERUMINSTITUT (DK) 1993-09-16 WO disclosed