SCHEMBL9026359

SCHEMBL9026359

COc1c(CO)nc(OCc2ccccc2Cl)c(CC(C)C)[n+]1[O-]

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 1/20 0.35
CSF1R P07333 1/20 0.35
MAPT P10636 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
RAB9A P51151 2/20 0.34
HPGD P15428 2/20 0.34
S1PR4 O95977 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
S1PR1 P21453 1/20 0.34
MAPK1 P28482 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
GPR35 Q9HC97 1/20 0.34
MPO P05164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
MAOB P27338 2/20 0.33
MAOA P21397 1/20 0.33
SCN9A Q15858 1/20 0.33
NPC1 O15118 1/20 0.33
NFKB1 P19838 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
SCHEMBL9026964 0.91 CSF1R (0.34) HDAC8CSF1RMAPTSMN1; SMN2RAB9A
SCHEMBL9026358 0.87 NR4A2 (0.39) HDAC8MAPTSMN1; SMN2RAB9AHPGD
SCHEMBL9026387 0.86 SCN9A (0.36) HDAC8CSF1RMAPTSMN1; SMN2RAB9A
SCHEMBL9026581 0.76 ALDH1A1 (0.37) HPGDALDH1A1LMNAMAPK1NPSR1
SCHEMBL9026233 0.76 ALDH1A1 (0.40) SMN1; SMN2HPGDALDH1A1LMNAMAPK1
SCHEMBL9026857 0.75 MAPK1 (0.37) SMN1; SMN2RAB9AHPGDALDH1A1LMNA
SCHEMBL27310947 0.73 NR4A2 (0.43) HDAC8MAPTRAB9AHPGDALDH1A1
SCHEMBL9027006 0.72 ALDH1A1 (0.38) HDAC8HPGDALDH1A1LMNAMAPK1
SCHEMBL9026053 0.72 ALDH1A1 (0.40) HPGDALDH1A1LMNAMAPK1L3MBTL1
SCHEMBL9026948 0.72 LMNA (0.39) HDAC8SMN1; SMN2RAB9AHPGDALDH1A1

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 5 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
CN-1024797-C Indole derivatives OTSUKA CHEMICAL CO LTD (JP) 1994-06-01 CN disclosed
US-5238938-A Nephrosis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-08-24 US disclosed
CN-1049155-A INDOLE DERIVATIVES OTSUKA CHEMICAL CO LTD (JP) 1991-02-13 CN 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