SCHEMBL8248060

SCHEMBL8248060

NC(=O)Cn1ccc2cc(N)ccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NTSR1 P30989 3/20 0.55
▸ PRKCI P41743 1/20 0.47
▸ LMNA P02545 1/20 0.44
▸ PLAU P00749 4/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ FAAH O00519 1/20 0.42
▸ PLG P00747 3/20 0.42
▸ BRPF1 P55201 1/20 0.40
▸ CHEK1 O14757 1/20 0.40
▸ AURKA O14965 1/20 0.40
▸ DAPK3 O43293 1/20 0.40
▸ CSNK1A1 P48729 1/20 0.40
▸ GSK3A P49840 1/20 0.40
▸ LIMK1 P53667 1/20 0.40
▸ IKBKE Q14164 1/20 0.40
▸ MAPK14 Q16539 1/20 0.40
▸ TAOK1 Q7L7X3 1/20 0.40
▸ CLK4 Q9HAZ1 1/20 0.40
▸ DYRK1B Q9Y463 1/20 0.40
▸ HTR6 P50406 1/20 0.38

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
SCHEMBL3353214 0.87 LMNA (0.44) NTSR1PRKCILMNAKMT2AHTR6
SCHEMBL13139586 0.85 NTSR1 (0.57) NTSR1PRKCIPLAUKMT2APLG
SCHEMBL2014724 0.82 HTR2C (0.55) LMNAPLAUKMT2AFAAHPLG
SCHEMBL2008953 0.82 HTR2A (0.55) NTSR1LMNAPLAUKMT2AFAAH
SCHEMBL2006946 0.82 HTR2A (0.55) LMNAPLAUKMT2AFAAHPLG
SCHEMBL14876504 0.81 NTSR1 (0.57) NTSR1PRKCIKMT2ABRPF1CHEK1
SCHEMBL28189356 0.81 NTSR1 (0.53) NTSR1PRKCIPLAUKMT2APLG
SCHEMBL1666483 0.79 NTSR1 (0.52) NTSR1PRKCILMNAATM
SCHEMBL13836584 0.78 NTSR1 (0.51) NTSR1PRKCIKMT2ABRPF1CHEK1
SCHEMBL1519806 0.77 KMT2A (0.71) NTSR1LMNAPLAUKMT2AHTR6

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-2007022321-A2 SUBSTITUTED INDOLES AND USE THEREOF WYETH (US) 2007-02-22 — — WO disclosed
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