SCHEMBL16680922

SCHEMBL16680922

CC(=CC(=O)OC(C)(C)C)C(=O)Oc1ccc(N)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 6/20 0.40
CYP19A1 P11511 1/20 0.36
NR1H4 Q96RI1 1/20 0.35
TDP1 Q9NUW8 3/20 0.34
MAPT P10636 2/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
THRB P10828 1/20 0.34
BLM P54132 1/20 0.34
CASP6 P55212 1/20 0.34
GFER P55789 1/20 0.34
MAPK1 P28482 2/20 0.33
ALDH1A1 P00352 2/20 0.33
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
F2 P00734 2/20 0.33
PRSS1 P07477 2/20 0.33
PRSS2 P07478 2/20 0.33

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
SCHEMBL17054140 0.85 CYP3A4 (0.39) CYP19A1MAPTALDH1A1F2KMT2A
SCHEMBL16681552 0.82 LMNA (0.37) ELANECYP19A1NR1H4MAPTGAA
SCHEMBL16680875 0.80 NR1H2 (0.33) CYP19A1MAPK1ALDH1A1NR1H2
SCHEMBL16681320 0.77 TSHR (0.38) ELANETDP1KDM4EBLMALDH1A1
SCHEMBL20348446 0.74 CYP19A1 (0.41) ELANECYP19A1TDP1MAPTKDM4E
SCHEMBL16679875 0.74 ACHE (0.37) CYP3A4
SCHEMBL2366870 0.74 ELANE (0.68) ELANENR1H4TDP1MAPTKDM4E
SCHEMBL16680531 0.74 ELANE (0.42) ELANENR1H4TDP1MAPTKDM4E
SCHEMBL29135149 0.73 CYP19A1 (0.47) CYP19A1TDP1MAPTKDM4EGLA
SCHEMBL29092146 0.73 DGAT1 (0.32)

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-9128378-B2 Forming conductive metal patterns with reactive polymers EASTMAN KODAK COMPANY (US) 2015-09-08 US disclosed
US-20150125667-A1 FORMING CONDUCTIVE METAL PATTERNS WITH REACTIVE POLYMERS BANK OF AMERICA, N.A., AS AGENT 2015-05-07 US disclosed