SCHEMBL9370908

SCHEMBL9370908

CNC(=O)c1cc(OC)c(OC)c(OC)c1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.54
HPGD P15428 1/20 0.54
KDM4E B2RXH2 2/20 0.53
POLB P06746 2/20 0.53
HSD17B10 Q99714 2/20 0.49
USP2 O75604 1/20 0.49
PLK1 P53350 1/20 0.47
PDE3B Q13370 1/20 0.47
PDE3A Q14432 1/20 0.47
MAPT P10636 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
PKM P14618 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
FGFR1 P11362 1/20 0.43
FGFR2 P21802 1/20 0.43
FGFR4 P22455 1/20 0.43
FGFR3 P22607 1/20 0.43
PTK2 Q05397 1/20 0.43

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
SCHEMBL21689951 0.82 ALDH1A1 (0.51) ALDH1A1HPGDKDM4EPOLBPLK1
SCHEMBL6392944 0.81 PLK1 (0.60) ALDH1A1HPGDPLK1MAPTRAB9A
SCHEMBL6270454 0.81 FAAH (0.59) ALDH1A1HPGDHSD17B10SMN1; SMN2
Hydrochloric Acid SCHEMBL27655722 0.80 PLK1 (0.58) ALDH1A1HPGDPLK1MAPTRAB9A
SCHEMBL7954427 0.79 CYP3A4 (0.57) ALDH1A1KDM4EHSD17B10PLK1MAPT
SCHEMBL1438926 0.79 PKM (0.62) ALDH1A1HPGDKDM4EPOLBHSD17B10
SCHEMBL15233646 0.77 KDM4E (0.51) ALDH1A1HPGDKDM4EPOLBHSD17B10
SCHEMBL28921381 0.77 KDM4E (0.56) ALDH1A1HPGDKDM4EPOLBHSD17B10
SCHEMBL4143482 0.77 ALDH1A1 (0.77) ALDH1A1HPGDPOLBPLK1MAPT
SCHEMBL26136284 0.77 KDM4E (0.51) ALDH1A1HPGDKDM4EPOLBHSD17B10

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
EP-0574494-A4 INDOLES USEFUL AS PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LAB (US) 1994-07-06 EP disclosed
EP-0574494-A1 INDOLES USEFUL AS PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LABORATORIES (US) 1993-12-22 EP disclosed
WO-1992014732-A1 INDOLES USEFUL AS PLATELET ACTIVATING FACTOR ANTAGONISTS ABBOTT LABORATORIES (US) 1992-09-03 WO disclosed