SCHEMBL9749387

SCHEMBL9749387

[N-]=[N+]=C1C(=O)N(CCCCCCCCCCCCN2C(=O)C(=[N+]=[N-])C(=O)N(C3CCCCC3)C2=O)C(=O)N(C2CCCCC2)C1=O

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
MAPT P10636 3/20 0.39
HTT P42858 2/20 0.39
CYP2C9 P11712 2/20 0.39
CYP2C19 P33261 2/20 0.39
ALOX15 P16050 1/20 0.39
CREBBP Q92793 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ALDH1A1 P00352 5/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 2/20 0.34
BBOX1 O75936 1/20 0.33
ASPH Q12797 1/20 0.33
KDM8 Q8N371 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
HIF1AN Q9NWT6 1/20 0.33
CDC25B P30305 1/20 0.33
EPHX2 P34913 4/20 0.33
MAPK1 P28482 1/20 0.32

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
SCHEMBL9748725 0.92 ALDH1A1 (0.39) LMNAMAPTHTTCYP2C9CYP2C19
SCHEMBL9749762 0.83 LMNA (0.53) LMNAMAPTHTTCYP2C9CYP2C19
SCHEMBL9749122 0.72 PTGS1 (0.44) ALDH1A1TP53EPHX2
SCHEMBL9749352 0.71 KMT2A (0.43) LMNAMAPTHTTCYP2C9CYP2C19
SCHEMBL5634034 0.69 CDC25B (0.38) LMNAMAPTHTTCYP2C9CYP2C19
SCHEMBL5633433 0.69 CDC25B (0.38) LMNAMAPTHTTCYP2C9CYP2C19
SCHEMBL21334214 0.68 CYP2C9 (0.35) LMNAMAPTHTTCYP2C9CYP2C19
SCHEMBL5634058 0.67 CDC25B (0.37) LMNAMAPTHTTCYP2C9CYP2C19
SCHEMBL6233648 0.66 LMNA (0.47) LMNAMAPTHTTCYP2C9CYP2C19
SCHEMBL6232883 0.66 LMNA (0.60) LMNAMAPTHTTCYP2C9CYP2C19

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