SCHEMBL8395395

SCHEMBL8395395

CC(C)(C)C(=O)Oc1ccc(NC=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ELANE P08246 15/20 0.59
PRTN3 P24158 3/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL22369614 0.81 ELANE (0.86) ELANEPRTN3
SCHEMBL23135278 0.80 ELANE (0.66) ELANEPRTN3MEN1KMT2AALDH1A1
SCHEMBL2831697 0.80 MAPT (0.58) ELANEMEN1KMT2AALDH1A1KDM4E
SCHEMBL19201617 0.79 ELANE (0.63) ELANEPRTN3MEN1KMT2A
SCHEMBL11810932 0.77 MEN1 (0.47) MEN1KMT2AALDH1A1KDM4EGAA
Hydrochloric Acid SCHEMBL20679035 0.77 ELANE (0.61) ELANEPRTN3MEN1KMT2A
SCHEMBL28702876 0.77 L3MBTL1 (0.68) ELANEMEN1KMT2AALDH1A1MAPT
SCHEMBL1666256 0.77 ELANE (0.66) ELANEPRTN3KMT2AALDH1A1
SCHEMBL11808720 0.77 MEN1 (0.49) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL28098390 0.76 KMT2A (0.54) ELANEMEN1KMT2AALDH1A1KDM4E

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
JP-11263778-A None JP disclosed
JP-H11263778-A AMINOMETHYLENEPYRIMIDINE DERIVATIVE, ITS PRODUCTION AND USE CHEMIPROKASEI KAISHA LTD 1999-09-28 JP disclosed