SCHEMBL9204754

SCHEMBL9204754

CCCOC(=Cc1ccccc1)C(=O)c1ccc(C(=O)N(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
ALDH1A1 P00352 7/20 0.40
HPGD P15428 4/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
POLB P06746 1/20 0.39
CYP2D6 P10635 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KIF11 P52732 1/20 0.37
ESR1 P03372 1/20 0.37
CHRM1 P11229 1/20 0.37
TSHR P16473 1/20 0.37
SLC6A2 P23975 1/20 0.37
KDR P35968 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MAPT P10636 3/20 0.36
GAA P10253 1/20 0.36
THRB P10828 1/20 0.36
BCHE P06276 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
SCHEMBL9203802 0.92 BCHE (0.41) LMNAKMT2AMEN1ALDH1A1HPGD
SCHEMBL9203895 0.89 MEN1 (0.51) LMNAKMT2AMEN1ALDH1A1HPGD
SCHEMBL27975595 0.87 LMNA (0.57) LMNAKMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL9206588 0.85 CYP11B1 (0.34) KMT2AALDH1A1HPGDSMN1; SMN2CYP2D6
SCHEMBL9202752 0.84 HDAC8 (0.39) LMNAALDH1A1HPGDSMN1; SMN2KIF11
SCHEMBL9208251 0.82 PRSS1 (0.33) LMNAKMT2AMEN1ALDH1A1HPGD
SCHEMBL9207327 0.82 ALDH1A1 (0.45) LMNAKMT2AMEN1ALDH1A1HPGD
SCHEMBL9200646 0.80 ELANE (0.39) LMNAKMT2AMEN1ALDH1A1HPGD
SCHEMBL9204169 0.78 ALDH1A1 (0.41) LMNAKMT2AMEN1ALDH1A1HPGD
SCHEMBL9202154 0.78 ALDH1A1 (0.41) LMNAKMT2AMEN1ALDH1A1HPGD

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