SCHEMBL7355432

SCHEMBL7355432

COc1c(C=C[N+](=O)[O-])cccc1OCCCCCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.62
ALDH1A1 P00352 3/20 0.45
LMNA P02545 3/20 0.45
MAPT P10636 3/20 0.45
HPGD P15428 3/20 0.45
NPC1 O15118 2/20 0.45
MAPK1 P28482 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
S1PR1 P21453 2/20 0.45
S1PR4 O95977 1/20 0.45
ITGA4 P13612 1/20 0.45
TLR9 Q9NR96 1/20 0.45
TLR4 O00206 2/20 0.44
TLR2 O60603 2/20 0.44
KDM4E B2RXH2 1/20 0.41
USP2 O75604 1/20 0.41
NSD2 O96028 1/20 0.41
POLB P06746 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
SCHEMBL7355908 0.91 PRMT1 (0.62) PRMT1ALDH1A1LMNAMAPTHPGD
SCHEMBL7355906 0.91 PRMT1 (0.62) PRMT1ALDH1A1LMNAMAPTHPGD
SCHEMBL17583850 0.85 PRMT1 (0.69) PRMT1ALDH1A1LMNAMAPTHPGD
SCHEMBL17583849 0.85 PRMT1 (0.69) PRMT1ALDH1A1LMNAMAPTHPGD
SCHEMBL7361871 0.82 TLR4 (0.49) PRMT1ALDH1A1LMNAMAPTHPGD
SCHEMBL7361868 0.82 TLR4 (0.49) PRMT1ALDH1A1LMNAMAPTHPGD
SCHEMBL5733568 0.80 PRMT1 (0.76) PRMT1ALDH1A1LMNAMAPTHPGD
SCHEMBL7990689 0.78 MAPT (0.63) ALDH1A1LMNAMAPTHPGDNPC1
SCHEMBL7353840 0.78 MAPT (0.63) ALDH1A1LMNAMAPTHPGDNPC1
SCHEMBL1011167 0.78 PRMT1 (1.00) PRMT1ALDH1A1LMNAMAPTMAPK1

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-6297257-B1 Benzazine derivatives phosphodiesterase 4 inhibitors ZAMBON GROUP S.P.A. (IT) 2001-10-02 US disclosed
EP-1060173-A2 BENZAZINE DERIVATIVES PHOSPHODIESTERASE 4 INHIBITORS ZAMBON GROUP S.p.A. (IT) 2000-12-20 EP disclosed
WO-1999032449-A2 BENZAZINE DERIVATIVES AS PHOSPHODIESTERASE 4 INHIBITORS ZAMBON GROUP S.P.A. (IT) 1999-07-01 WO disclosed