SCHEMBL11515699

SCHEMBL11515699

CC(=O)ONc1nc(CC(=O)Nc2cccc(C(F)(F)F)c2)cs1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.57
CTPS1 P17812 6/20 0.52
MAPT P10636 7/20 0.51
NPSR1 Q6W5P4 3/20 0.51
HTT P42858 3/20 0.51
HPGD P15428 1/20 0.51
GPR35 Q9HC97 1/20 0.51
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
CYP1A2 P05177 3/20 0.51
CYP3A4 P08684 3/20 0.51
CYP2D6 P10635 3/20 0.51
CYP2C9 P11712 3/20 0.51
CYP2C19 P33261 3/20 0.51
ALDH1A1 P00352 2/20 0.51
LMNA P02545 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
UBE2N P61088 1/20 0.50
GAA P10253 2/20 0.49
XBP1 P17861 1/20 0.49

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
SCHEMBL11517104 0.86 PDE5A (0.62) PDE5ACTPS1MAPTNPSR1HTT
SCHEMBL11516869 0.84 PDE5A (0.62) PDE5ACTPS1MAPTNPSR1HTT
SCHEMBL11519026 0.84 PDE5A (0.62) PDE5ACTPS1MAPTNPSR1HTT
SCHEMBL11516149 0.83 PDE5A (0.64) PDE5ACTPS1MAPTNPSR1HTT
SCHEMBL11517733 0.80 PDE5A (0.56) PDE5ACTPS1MAPTNPSR1HTT
SCHEMBL24101686 0.78 PDE5A (0.63) PDE5ACTPS1MAPTNPSR1HTT
SCHEMBL14069823 0.78 MAPT (0.59) PDE5AMAPTNPSR1HTTHPGD
SCHEMBL11518120 0.75 MAPT (0.50) PDE5ACTPS1MAPTNPSR1HTT
SCHEMBL11516872 0.74 MAPT (0.49) PDE5ACTPS1MAPTNPSR1HTT
SCHEMBL27768800 0.71 SMN1; SMN2 (0.75) MAPTNPSR1HTTMEN1KMT2A

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
US-4152329-A 2-ACYLAMINOTHIAZOL-4-YLACETAMIDES AS POST-EMERGENT SELECTIVE HERBICIDES GULF OIL CORPORATION (US) 1979-05-01 US disclosed
US-4120690-A 2-Acylaminothiazol-4-ylacetamides as post-emergent selective herbicides GULF OIL CORPORATION (US) 1978-10-17 US disclosed