SCHEMBL9027221

SCHEMBL9027221

COc1cc2[nH]cc(Cc3nc(OCc4ccccc4)c(CC(C)C)[n+]([O-])c3OC)c2cc1OC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.36
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
CTSV O60911 2/20 0.35
CTSL P07711 2/20 0.35
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 1/20 0.35
LTA4H P09960 1/20 0.35
PLA2G2A P14555 1/20 0.35
IDO1 P14902 1/20 0.35
KDM1A O60341 1/20 0.34
POLB P06746 1/20 0.33
ELANE P08246 1/20 0.33
SRD5A1 P18405 1/20 0.33
SRD5A2 P31213 1/20 0.33
MAPT P10636 5/20 0.33
LMNA P02545 3/20 0.33
TRPM8 Q7Z2W7 2/20 0.33
MITF O75030 1/20 0.33
MAPK1 P28482 1/20 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
SCHEMBL9026147 0.90 KMT2A (0.40) KMT2AMEN1POLBMAPTLMNA
SCHEMBL9027482 0.89 PCSK9 (0.38) KMT2AMEN1HSP90AA1HSP90AB1LTA4H
SCHEMBL9025363 0.89 LTA4H (0.46) KMT2AMEN1HSP90AA1HSP90AB1LTA4H
SCHEMBL9026402 0.89 GPR84 (0.45) KMT2AMEN1HSP90AA1HSP90AB1LTA4H
SCHEMBL9026872 0.83 SOS2 (0.38) LTA4HPLA2G2AMAPTTRPM8SMN1; SMN2
SCHEMBL9026638 0.82 KMT2A (0.39) KMT2AMEN1POLBMAPTLMNA
SCHEMBL9027273 0.81 KMT2A (0.38) KMT2AMEN1POLBMAPTLMNA
SCHEMBL9026084 0.80 KCNA5 (0.38) KMT2AMEN1HTR1DPTPN1
SCHEMBL9026979 0.79 GPR84 (0.41) KMT2AMEN1POLBMAPTHTR1D
SCHEMBL9027253 0.78 KMT2A (0.40) KMT2AMEN1POLBMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0411150-B1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMA CO LTD (JP) 1996-11-27 EP disclosed