SCHEMBL9750349

SCHEMBL9750349

O=C(NCCCCCCCCCCCCNC(=O)NC1CCCCC1)NC1CCCCC1

nearest known ligand 0.86

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 14/20 0.86
EPHX2 P34913 4/20 0.83
KDM4E B2RXH2 1/20 0.70
ALDH1A1 P00352 1/20 0.70

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
SCHEMBL19420509 1.00 EPHX1 (0.86) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL12196088 0.93 EPHX1 (1.00) EPHX1EPHX2
SCHEMBL19420689 0.93 EPHX1 (0.76) EPHX1EPHX2
SCHEMBL12196092 0.91 EPHX1 (1.00) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL652844 0.91 EPHX1 (1.00) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL7561514 0.91 EPHX1 (1.00) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL12196099 0.91 EPHX1 (1.00) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL4997375 0.91 EPHX1 (1.00) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL1059134 0.91 EPHX1 (1.00) EPHX1EPHX2KDM4EALDH1A1
SCHEMBL12196095 0.91 EPHX1 (1.00) EPHX1EPHX2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0346339-B1 BARBITURIC ACID COMPOUNDS, PHOTORESISTS THEREFROM AND METHOD FOR PREPARATION HOECHST CELANESE CORPORATION (US) 1992-09-09 EP disclosed
US-4902784-A 1,3 Disubstituted-5-diazobarbituric acids HOECHST CELANESE CORPORATION (US) 1990-02-20 US disclosed
EP-0346339-A1 BARBITURIC ACID COMPOUNDS, PHOTORESISTS THEREFROM AND METHOD FOR PREPARATION. HOECHST CELANESE CORP (US) 1989-12-20 EP disclosed
WO-1989005800-A1 NOVEL BARBITURIC ACID COMPOUNDS, PHOTORESISTS THEREFROM AND METHOD FOR PREPARATION HOECHST CELANESE CORPORATION (US) 1989-06-29 WO disclosed
US-4735885-A Deep UV photoresist composition with 1,3-disubstituted-5-diazobarbituric acids ALLIED CORPORATION (US) 1988-04-05 US disclosed