SCHEMBL3962933

SCHEMBL3962933

COCCc1cc2cc([N+](=O)[O-])ccc2[nH]1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.48
HRH4 Q9H3N8 1/20 0.43
MAPT P10636 7/20 0.42
POLB P06746 1/20 0.42
MAOB P27338 1/20 0.42
NOS1 P29475 1/20 0.42
KDM4E B2RXH2 2/20 0.42
CTSV O60911 1/20 0.42
CTSL P07711 1/20 0.42
GRIA1 P42261 1/20 0.42
GRIA2 P42262 1/20 0.42
GRIA3 P42263 1/20 0.42
GRIA4 P48058 1/20 0.42
ALDH1A1 P00352 3/20 0.41
LMNA P02545 3/20 0.41
KCNJ1 P48048 2/20 0.41
GAA P10253 3/20 0.40
UBE2N P61088 1/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 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
SCHEMBL7807147 0.84 KDM4E (0.55) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL28761405 0.84 CYP19A1 (0.46) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL9486575 0.82 CYP19A1 (0.49) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL6595669 0.81 CYP19A1 (0.41) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL6597520 0.81 CYP19A1 (0.51) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL6257538 0.81 CYP19A1 (0.54) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL28923795 0.81 KCNH2 (0.50) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL8104671 0.81 CYP19A1 (0.48) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL6257958 0.81 CYP19A1 (0.48) CYP19A1HRH4MAPTPOLBMAOB
SCHEMBL27532988 0.79 CYP19A1 (0.55) 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