SCHEMBL9027335

SCHEMBL9027335

COc1c(Cc2c(Cl)[nH]c3ccccc23)nc(Cl)c(CC(C)C)[n+]1[O-]

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA7 P36544 1/20 0.31
CHRNA4 P43681 1/20 0.31

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
SCHEMBL9026927 0.88 GABRP (0.33)
SCHEMBL9025873 0.82 GPR84 (0.41)
SCHEMBL9027465 0.75 CNR1 (0.33)
SCHEMBL9027162 0.75 ALDH1A1 (0.39) NR4A2CHRNB2CHRNA7CHRNA4
SCHEMBL9025808 0.74 TUBB4A (0.41)
SCHEMBL9027478 0.74 CNR1 (0.32) CHRNB2CHRNA7CHRNA4
SCHEMBL9026185 0.71 GPR84 (0.41)
SCHEMBL9026979 0.71 GPR84 (0.41)
SCHEMBL9025439 0.69 KDM4E (0.33) CHRNB2CHRNA7CHRNA4
SCHEMBL9025798 0.68 CHRNB2 (0.34) CHRNB2CHRNA7CHRNA4

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