SCHEMBL3467047

SCHEMBL3467047

Cc1cc2cc3ccoc3cc2oc1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.59
HSD17B10 Q99714 3/20 0.59
ACHE P22303 3/20 0.59
CYP2A6 P11509 3/20 0.59
MAOA P21397 2/20 0.59
KDM4E B2RXH2 1/20 0.59
CYP2D6 P10635 1/20 0.59
CYP2C9 P11712 1/20 0.59
NFKB1 P19838 1/20 0.59
CYP2C19 P33261 1/20 0.59
HTT P42858 1/20 0.57
HSD17B3 P37058 1/20 0.56
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49
PTPN1 P18031 3/20 0.41
HPGD P15428 2/20 0.39
CYP1A1 P04798 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
THRB P10828 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL8936325 0.80 MAOA (0.56) CYP3A4HSD17B10ACHECYP2A6MAOA
SCHEMBL7830030 0.79 CYP2A6 (0.59) CYP3A4HSD17B10ACHECYP2A6MAOA
SCHEMBL5488820 0.79 CYP2A6 (0.59) CYP3A4HSD17B10ACHECYP2A6MAOA
SCHEMBL4235603 0.79 CYP3A4 (0.59) CYP3A4HSD17B10ACHECYP2A6MAOA
SCHEMBL1301705 0.79 CYP3A4 (0.62) CYP3A4HSD17B10ACHECYP2A6MAOA
SCHEMBL4419299 0.78 CYP3A4 (0.56) CYP3A4HSD17B10ACHECYP2A6MAOA
SCHEMBL15842923 0.77 HSD17B3 (0.60) HSD17B10ACHEHSD17B3HPGDADORA3
SCHEMBL17083899 0.77 HSD17B3 (0.56) ACHEMAOAKDM4EHSD17B3HPGD
SCHEMBL6994969 0.76 ALDH2 (0.56) CYP3A4HSD17B10ACHECYP2A6MAOA
SCHEMBL4247907 0.76 MAOA (0.54) CYP3A4HSD17B10ACHECYP2A6MAOA

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113939288-A Modulators of MAS-related G protein receptor X4 and related products and methods 伊赛恩特制药公司 2022-01-14 CN claimed
CN-114449991-B Oral care compositions with anticaries activity 宝洁公司 2024-07-16 CN disclosed
CN-118159250-A Blocked emulsion toothpaste compositions 宝洁公司 2024-06-07 CN disclosed
CN-118103017-A Blocked emulsion toothpaste compositions 宝洁公司 2024-05-28 CN disclosed
CN-118103025-A Blocked emulsion toothpaste compositions comprising fluoride 宝洁公司 2024-05-28 CN disclosed
CN-118078878-A Application of fructus psoraleae in preparation of bacteriostat or bactericide of mycobacterium abscessus 浙江大学医学院附属第一医院(浙江省第一医院) 2024-05-28 CN disclosed
CN-114466642-B Oral care compositions comprising hops beta acids and fluoride 宝洁公司 2024-04-23 CN disclosed
CN-117098522-A Oral care compositions comprising hops and sweetener 宝洁公司 2023-11-21 CN disclosed
CN-117083053-A Edible oral composition comprising hops 宝洁公司 2023-11-17 CN disclosed
CN-117042751-A Oral care compositions comprising hops 宝洁公司 2023-11-10 CN disclosed
WO-2015049694-A9 TOPICAL PIGMENTORY COMPOSITION BANERJI SANJAY (IN) 2016-02-04 WO disclosed
WO-2015049694-A1 TOPICAL PIGMENTORY COMPOSITION BANERJI SANJAY (IN) 2015-04-09 WO disclosed
EP-2819696-A1 METHOD FOR THE PREPARATION OF DENDRITIC CELL VACCINES Laboratorios Del. Dr. Esteve, S.A. (ES) 2015-01-07 EP disclosed
WO-2013127976-A1 METHOD FOR THE PREPARATION OF DENDRITIC CELL VACCINES LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2013-09-06 WO disclosed
WO-2010069073-A1 COMBINATION OF PHOTODYNAMIC THERAPY AND ANTI-VEGF AGENTS IN THE TREATMENT OF UNWANTED CHOROIDAL NEOVASCULATURE QLT INC. (CA) 2010-06-24 WO disclosed
WO-2003007944-A1 TREATMENT OF MACULAR EDEMA WITH PHOTODYNAMIC THERAPY QLT, INC. (CA) 2003-01-30 WO disclosed
US-5179217-A Skin disorders BACCICHETTI FRANCAROSA (IT) 1993-01-12 US disclosed
US-5001147-A Photochemotherapic method of treating psoriasis by using methylangelicin compounds CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 1991-03-19 US disclosed
US-4312883-A ADMINISTERED TOPICALLY OR ORALLY FOLLOWED BY ULTRAVIOLET RADIATION OF AFFECTED AREA CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 1982-01-26 US disclosed
US-4260630-A PSORIASIS, 3-CARBOXY OR CYANO-SUBSTITUTED PSORALEN DERIVATIVE WITH UV RADIATION AGENCE NATIONALE DE VALORISATION DE LA RECHERCHE (ANVAR) (FR) 1981-04-07 US disclosed