SCHEMBL9026401

SCHEMBL9026401

COc1c(C(=O)c2c[nH]c3ccccc23)nc(OCc2ccccc2)c(CC(C)C)[n+]1[O-]

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.39
TP53 P04637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAPT P10636 6/20 0.39
HPGD P15428 1/20 0.39
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
GPR84 Q9NQS5 1/20 0.37
MMP1 P03956 2/20 0.37
MMP2 P08253 2/20 0.37
MMP3 P08254 2/20 0.37
MMP7 P09237 2/20 0.37
NR4A2 P43354 1/20 0.36
CREBBP Q92793 1/20 0.36
PIM1 P11309 1/20 0.36
KDM4E B2RXH2 1/20 0.36
APAF1 O14727 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL9027006 0.82 ALDH1A1 (0.38) HPGDMMP2NR4A2L3MBTL1LMNA
SCHEMBL9026948 0.82 LMNA (0.39) SMN1; SMN2HPGDNPC1RAB9AMMP2
SCHEMBL27257352 0.81 SMN1; SMN2 (0.42) SMN1; SMN2TP53NPSR1MAPTHPGD
SCHEMBL9026147 0.80 KMT2A (0.40) MAPTMEN1KMT2AGPR84MMP2
SCHEMBL27258448 0.78 LMNA (0.39) SMN1; SMN2MAPTHPGDMEN1KMT2A
SCHEMBL9026029 0.77 ALDH1A1 (0.40) NPSR1MAPTHPGDL3MBTL1LMNA
SCHEMBL9027351 0.75 SMN1; SMN2 (0.44) SMN1; SMN2TP53NPSR1MAPTHPGD
SCHEMBL9026638 0.74 KMT2A (0.39) MAPTMEN1KMT2AGPR84MMP2
SCHEMBL9026324 0.74 JAK2 (0.36) SMN1; SMN2MAPTMEN1KMT2ANPC1
SCHEMBL9025363 0.73 LTA4H (0.46) MAPTMEN1KMT2AGPR84MMP2

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-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
US-5238938-A Nephrosis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-08-24 US disclosed
EP-0411150-A1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-02-06 EP disclosed