SCHEMBL10587249

SCHEMBL10587249

O=C(Nc1ccc(Cl)cc1)N(Cc1ccccc1CN(C(=O)Nc1ccc(Cl)cc1)C1CCCCCC1)C1CCCCCC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 1/20 0.58
SLC6A5 Q9Y345 1/20 0.58
POLB P06746 2/20 0.57
TP53 P04637 5/20 0.56
SMN1; SMN2 Q16637 3/20 0.55
ALDH1A1 P00352 4/20 0.55
AGER Q15109 1/20 0.52
UBE2M P61081 2/20 0.52
DCUN1D1 Q96GG9 2/20 0.52
MAPT P10636 3/20 0.51
ATM Q13315 1/20 0.49
USP2 O75604 2/20 0.48
KDM4E B2RXH2 1/20 0.48
HPGD P15428 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48
HSD17B10 Q99714 1/20 0.48
LMNA P02545 1/20 0.47
PTBP1 P26599 1/20 0.47
MEN1 O00255 1/20 0.47

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
SCHEMBL7802288 0.87 DCUN1D1 (0.66) SLC6A9SLC6A5ALDH1A1AGERUBE2M
SCHEMBL10587267 0.87 SLC6A9 (0.61) SLC6A9SLC6A5POLBTP53SMN1; SMN2
SCHEMBL11621624 0.86 AGER (0.64) SLC6A9SLC6A5TP53SMN1; SMN2ALDH1A1
SCHEMBL9257544 0.85 SLC6A9 (0.59) SLC6A9SLC6A5POLBTP53SMN1; SMN2
SCHEMBL23200143 0.85 MEN1 (0.62) POLBTP53SMN1; SMN2ALDH1A1MAPT
Pencycuron SCHEMBL22525 0.85 AGER (0.62) SLC6A9SLC6A5TP53SMN1; SMN2ALDH1A1
Pencycuron SCHEMBL8817027 0.85 AGER (0.62) SLC6A9SLC6A5TP53SMN1; SMN2ALDH1A1
SCHEMBL23200125 0.84 SLC6A9 (0.55) SLC6A9SLC6A5POLBTP53SMN1; SMN2
SCHEMBL23200115 0.82 TSHR (0.55) SLC6A9SLC6A5POLBTP53SMN1; SMN2
SCHEMBL23200085 0.81 SMN1; SMN2 (0.66) POLBTP53SMN1; SMN2ALDH1A1UBE2M

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
EP-0325397-A1 Diurea derivatives useful as medicaments and processes for the preparation thereof YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1989-07-26 EP disclosed