SCHEMBL3246489

SCHEMBL3246489

O=C1CCc2cc(-c3cc(Cl)cc(Cl)c3)cnc2N1CC(=O)n1cc2ccccc2c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 6/20 0.36
BMPR1B O00238 1/20 0.34
BMPR1A P36894 1/20 0.34
ACVRL1 P37023 1/20 0.34
ACVR1 Q04771 1/20 0.34
MEN1 O00255 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
FNTA P49354 2/20 0.33
FNTB P49356 2/20 0.33
USP30 Q70CQ3 1/20 0.33
GRIN2B Q13224 3/20 0.32
KDM4E B2RXH2 3/20 0.32
LMNA P02545 2/20 0.32
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CYP11B1 P15538 1/20 0.32
GAA P10253 1/20 0.32
GFER P55789 1/20 0.32
CYP3A4 P08684 1/20 0.32

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
SCHEMBL3246493 0.85 FNTA (0.39) CYP11B2MEN1KMT2AFNTAFNTB
SCHEMBL3247390 0.82 GRIN2B (0.39) CYP11B2MEN1KMT2AUSP30GRIN2B
SCHEMBL3241068 0.82 CYP11B2 (0.41) CYP11B2BMPR1BBMPR1AACVRL1ACVR1
SCHEMBL3267887 0.82 MAPK1 (0.45) MEN1KMT2AKDM4ELMNAALDH1A1
SCHEMBL3239090 0.77 GRIN2B (0.41) GRIN2BKDM4ELMNAALDH1A1
SCHEMBL3130951 0.77 ESR1 (0.43) CYP11B2KDM4ELMNAALDH1A1SMN1; SMN2
SCHEMBL3240923 0.76 MET (0.38) CYP11B2BMPR1BBMPR1AACVRL1ACVR1
SCHEMBL3128413 0.76 KDM4E (0.36) CYP11B2MEN1RAB9AKMT2AKDM4E
SCHEMBL3122131 0.75 MAPK1 (0.43) MEN1RAB9AKMT2AALDH1A1CYP3A4
SCHEMBL3247305 0.73 LMNA (0.41) CYP11B2MEN1RAB9AKMT2AKDM4E

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
WO-2010008777-A2 FUSED AZABICYCLIC PYRIDINES LIGAND PHARMACEUTICALS INC. (US) 2010-01-21 WO claimed