SCHEMBL8308294

SCHEMBL8308294

COC(=O)C(N)CCNC=O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 4/20 0.37
ADH1A P07327 4/20 0.37
ADH7 P40394 3/20 0.37
ADH1C P00326 3/20 0.34
LTA4H P09960 2/20 0.34
DPP7 Q9UHL4 2/20 0.33
EPHX1 P07099 1/20 0.33
ADH4 P08319 1/20 0.33
KIF11 P52732 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
SLC1A1 P43005 1/20 0.32
CASR P41180 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
RRM1 P23921 1/20 0.31
GFPT1 Q06210 1/20 0.31

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
SCHEMBL23451025 0.89 ADH1B (0.41) ADH1BADH1AADH7ADH1CLTA4H
SCHEMBL27686000 0.80 P2RY10 (0.36) LTA4HKIF11CA1CA2SLC1A1
SCHEMBL13662314 0.80 P2RY10 (0.36) LTA4HKIF11CA1CA2SLC1A1
SCHEMBL8309760 0.80 ADH1B (0.44) ADH1BADH1AADH7ADH1CDPP7
SCHEMBL28540932 0.79 MAPT (0.37)
SCHEMBL28537547 0.79 MAPT (0.37)
SCHEMBL11776470 0.79 SMN1; SMN2 (0.42) LTA4HKIF11CA1CA2SLC1A1
SCHEMBL20041853 0.78 ADH1B (0.38) ADH1BADH1AADH7ADH1CEPHX1
SCHEMBL28144230 0.78 GSR (0.46) SLC1A1
SCHEMBL1301293 0.77 MAPT (0.37) LTA4HDPP7CA1CA2SLC1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5922741-A 5-aminopyrazoles useful as tyrosine kinase inhibitors CELLTECH THERAPEUTICS LTD. (GB) 1999-07-13 US disclosed
EP-0906286-A1 5-AMINOPYRAZOLES USEFUL AS SELECTIVE INHIBITORS OF THE PROTEIN TYROSINE KINASE P56ICK CELLTECH THERAPEUTICS LIMITED (GB) 1999-04-07 EP disclosed
WO-1997040019-A1 5-AMINOPYRAZOLES USEFUL AS SELECTIVE INHIBITORS OF THE PROTEIN TYROSINE KINASE P56ICK CELLTECH THERAPEUTICS LIMITED (GB) 1997-10-30 WO disclosed