SCHEMBL3962934

SCHEMBL3962934

COC(C)c1cc2cc([N+](=O)[O-])ccc2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.49
HRH4 Q9H3N8 1/20 0.43
MAPT P10636 4/20 0.43
POLB P06746 4/20 0.43
MAOB P27338 1/20 0.43
NOS1 P29475 1/20 0.43
GRIA1 P42261 1/20 0.43
GRIA2 P42262 1/20 0.43
GRIA3 P42263 1/20 0.43
GRIA4 P48058 1/20 0.43
CTSV O60911 1/20 0.43
CTSL P07711 1/20 0.43
SMN1; SMN2 Q16637 5/20 0.40
LMNA P02545 4/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
HTT P42858 2/20 0.40
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
NFKB1 P19838 1/20 0.40

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
SCHEMBL31735948 0.85 CYP19A1 (0.54) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL1465120 0.85 CYP19A1 (0.54) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL7968898 0.80 CYP19A1 (0.49) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL12824816 0.80 CYP19A1 (0.49) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL12825163 0.79 CYP19A1 (0.51) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL1465991 0.79 CYP19A1 (0.48) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL1465403 0.77 CYP19A1 (0.45) CYP19A1HRH4MAPTPOLBSMN1; SMN2
SCHEMBL30066709 0.76 CYP19A1 (0.54) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL30917347 0.73 CYP19A1 (0.60) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL317330 0.73 CYP19A1 (0.60) CYP19A1HRH4MAPTPOLBMAOB

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
WO-2024136630-A1 METHOD FOR SEQUENCE HOMOLOGY SEARCH OF NUCLEOTIDE DATABASE 주식회사 씨젠 2024-06-27 WO disclosed
WO-2009035177-A1 GENOTYPING OF HUMAN PAPILLOMA VIRUSES BY MULTIPLEX AMPLIFICATION AND SIZE DIFFERENTIATION SEEGENE, INC. (KR) 2009-03-19 WO disclosed
WO-2008143367-A1 HAPLOTYPING METHOD BY MULTIPLEX AMPLIFICATION SEEGENE, INC. (KR) 2008-11-27 WO disclosed
WO-2008111741-A1 METHOD FOR DETECTING NUCLEOTIDE VARIATIONS USING LABELLED PRIMERS SEEGENE, INC. (KR) 2008-09-18 WO disclosed
WO-2007097582-A1 OLIGONUCLEOTIDES FOR DETECTING NUCLEIC ACIDS OF PATHOGEN CAUSING SEXUALLY TRANSMITTED DISEASES SEEGENE, INC. (KR) 2007-08-30 WO disclosed