SCHEMBL8257977

SCHEMBL8257977

N#Cc1ccc(Cn2cncc2CCNC(=O)CSc2ccccc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 5/20 0.56
CYP11B2 P19099 5/20 0.56
FNTA P49354 12/20 0.53
FNTB P49356 12/20 0.53
PGGT1B P53609 9/20 0.53

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
SCHEMBL6985868 0.83 CYP11B1 (0.61) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL5891635 0.80 CYP11B1 (0.57) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL7484730 0.78 CYP11B1 (0.62) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL8531142 0.75 CYP11B1 (0.59) CYP11B1CYP11B2FNTAFNTBPGGT1B
Hydrochloric Acid SCHEMBL8191731 0.74 CYP11B1 (0.73) CYP11B1CYP11B2FNTAFNTBPGGT1B
Hydrochloric Acid SCHEMBL8534308 0.74 CYP11B1 (0.58) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL8413422 0.74 BRS3 (0.47)
SCHEMBL7477932 0.73 FNTA (0.56) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL8095394 0.73 FNTA (0.60) CYP11B1CYP11B2FNTAFNTBPGGT1B
SCHEMBL2786255 0.73 CYP11B1 (0.71) CYP11B1CYP11B2FNTAFNTBPGGT1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006102760-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2006-10-05 WO disclosed
US-5922883-A Inhibitors of farnesyl-protein transferase MERCK & CO., INC. (US) 1999-07-13 US disclosed