SCHEMBL29860575

SCHEMBL29860575

Cc1cc(S(=O)(=O)O)ccc1N=Nc1ccc(N=Nc2c(O)ccc3cccc(S(=O)(=O)O)c23)c(C)c1.[Na]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 1/20 0.55
▸ ATIC P31939 2/20 0.54
▸ MAPK1 P28482 4/20 0.53
▸ ALDH1A1 P00352 4/20 0.53
▸ CYP1A2 P05177 4/20 0.53
▸ CYP2C9 P11712 3/20 0.53
▸ GLO1 Q04760 2/20 0.52
▸ TDP1 Q9NUW8 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ GAA P10253 1/20 0.51
▸ MAPT P10636 1/20 0.51
▸ HIF1A Q16665 4/20 0.51
▸ HSD17B10 Q99714 2/20 0.51
▸ TSHR P16473 1/20 0.51
▸ PTPRA P18433 1/20 0.51
▸ PTPRB P23467 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ RAPGEF4 Q8WZA2 1/20 0.51
▸ ENPP2 Q13822 2/20 0.49
▸ CYP3A4 P08684 1/20 0.47

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
SCHEMBL29418971 0.87 THRB (0.56) PHLPP2ATICMAPK1ALDH1A1GLO1
SCHEMBL14418376 0.84 MAPK1 (0.65) PHLPP2MAPK1ALDH1A1CYP1A2CYP2C9
SCHEMBL16587015 0.83 PHLPP2 (0.67) PHLPP2ATICMAPK1ALDH1A1CYP1A2
SCHEMBL16587017 0.83 PHLPP2 (0.67) PHLPP2ATICMAPK1ALDH1A1CYP1A2
SCHEMBL5160460 0.79 CYP1A2 (0.71) MAPK1ALDH1A1CYP1A2CYP2C9GLO1
SCHEMBL12955458 0.79 CYP1A2 (0.71) MAPK1ALDH1A1CYP1A2CYP2C9GLO1
SCHEMBL751982 0.79 CYP1A2 (0.70) MAPK1ALDH1A1CYP1A2CYP2C9TDP1
SCHEMBL8528180 0.79 CYP1A2 (0.70) MAPK1ALDH1A1CYP1A2CYP2C9TDP1
SCHEMBL30742587 0.79 CYP1A2 (0.70) MAPK1ALDH1A1CYP1A2CYP2C9TDP1
SCHEMBL1435843 0.78 CYP1A2 (0.69) MAPK1ALDH1A1CYP1A2CYP2C9GLO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112946140-B Method for detecting water-soluble anion synthetic pigment in food 广州市食品检验所(广州市酒类检测中心) 2023-03-21 — — CN claimed
WO-2022188373-A1 METHOD FOR DETECTING WATER-SOLUBLE ANIONIC SYNTHETIC PIGMENT IN FOOD 广州市食品检验所(广州市酒类检测中心) 2022-09-15 — — WO claimed
US-20240301480-A1 METHODS AND COMPOSITIONS FOR ANALYZING NUCLEIC ACIDS AND NUCLEASES IN A BODY FLUID AS INDICATORS OF DISEASE ARNA GENOMICS US INCORPORATED 2024-09-12 — — US disclosed
US-20240167934-A1 EXCITATION-EMISSION MATRIX FLOW CYTOMETRY SYSTEMS AND USES THEREOF SCINTILLON INSTITUTE FOR BIOMEDICAL AND BIOENERGY RESEARCH 2024-05-23 — — US disclosed
EP-4291870-A1 EXCITATION-EMISSION MATRIX FLOW CYTOMETRY SYSTEMS AND USES THEREOF Scintillon Institute for Biomedical and Bioenergy Research (US) 2023-12-20 — — EP disclosed
US-20230400412-A1 FOLIC ACID FUNCTIONALIZED COPPER SULFIDE NANOPARTICLES FOR THE DETECTION OF OVARIAN CANCER CELLS IN FLOW ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY 2023-12-14 — — US disclosed
US-20230357868-A1 COMPOSITIONS AND METHODS FOR OBTAINING PLANT CULTIVARS WITH DESIRED TERPENE PROFILES BASED ON TERPENE SYNTHASE GENE SELECTION FRONT RANGE BIOSCIENCES INC (US) 2023-11-09 — — US disclosed
US-11788965-B2 Folic acid functionalized copper sulfide nanoparticles for the detection of ovarian cancer cells in flow ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) 2023-10-17 — — US disclosed
US-20230251194-A1 OPTICAL ANALYSES OF PARTICLES AND VESICLES SCINTILLON INSTITUTE FOR BIOMEDICAL AND BIOENERGY RESEARCH 2023-08-10 — — US disclosed
WO-2023086970-A2 METHODS AND COMPOSITIONS FOR ANALYZING NUCLEIC ACIDS AND NUCLEASES IN A BODY FLUID AS INDICATORS OF DISEASE ARNA GENOMICS US INCORPORATED (US) 2023-05-19 — — WO disclosed
CN-112946140-B Method for detecting water-soluble anion synthetic pigment in food 广州市食品检验所(广州市酒类检测中心) 2023-03-21 — — CN disclosed
US-11486829-B2 Optical analyses of particles and vesicles SCINTILLON INSTITUTE FOR BIOMEDICAL AND BIOENERGY RESEARCH (US) 2022-11-01 — — US disclosed
WO-2022188373-A1 METHOD FOR DETECTING WATER-SOLUBLE ANIONIC SYNTHETIC PIGMENT IN FOOD 广州市食品检验所(广州市酒类检测中心) 2022-09-15 — — WO disclosed
WO-2022174056-A1 EXCITATION-EMISSION MATRIX FLOW CYTOMETRY SYSTEMS AND USES THEREOF SCINTILLON INSTITUTE FOR BIOMEDICAL AND BIOENERGY RESEARCH (US) 2022-08-18 — — WO disclosed
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