SCHEMBL54645

SCHEMBL54645

c1ccc2c(c1)N=c1cc3c(cc1O2)=Nc1ccccc1O3

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.50
CYP2D6 P10635 2/20 0.50
TRPA1 O75762 4/20 0.43
HRH4 Q9H3N8 4/20 0.39
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 2/20 0.38
NPC1 O15118 1/20 0.38
GAA P10253 1/20 0.38
RAB9A P51151 1/20 0.38
MAPK1 P28482 1/20 0.37
AHR P35869 1/20 0.37
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
ALOX5 P09917 1/20 0.36
HRH2 P25021 3/20 0.36
HRH1 P35367 3/20 0.36
ADRB2 P07550 2/20 0.36
CHRM2 P08172 2/20 0.36

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
SCHEMBL30589180 1.00 CYP1A2 (0.50) CYP1A2CYP2D6TRPA1HRH4KDM4E
SCHEMBL10597663 0.94 CYP1A2 (0.46) CYP1A2CYP2D6TRPA1HRH4KDM4E
SCHEMBL5700690 0.87 CYP1A2 (0.41) CYP1A2CYP2D6TRPA1HRH4KDM4E
SCHEMBL1947835 0.85 AHR (0.41) CYP1A2CYP2D6TRPA1HRH4KDM4E
SCHEMBL815892 0.82 CYP1A2 (0.38) CYP1A2CYP2D6TRPA1HRH4
SCHEMBL10898650 0.82 CYP1A2 (0.45) CYP1A2CYP2D6TRPA1HRH4KDM4E
SCHEMBL9548219 0.81 AHR (0.38) CYP1A2CYP2D6TRPA1HRH4KDM4E
SCHEMBL7785366 0.80 CYP1A2 (0.42) CYP1A2CYP2D6TRPA1HRH4KDM4E
SCHEMBL10489065 0.80 AHR (0.36) CYP1A2CYP2D6TRPA1HRH4KDM4E
SCHEMBL8196063 0.80 CYP1A2 (0.42) CYP1A2CYP2D6TRPA1HRH4KDM4E

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

Appears in 5217 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4165465-B1 SYSTEMS AND METHODS FOR INDICATING THE TIME ELAPSED SINCE THE OCCURRENCE OF A TRIGGERING EVENT JOHNSON & JOHNSON VISION CARE (US) 2026-02-18 EP claimed
EP-3894532-B1 AN ENCAPSULATED DYE COMPOSITION AND A METHOD FOR PREPARATION THEREOF HEUBACH HOLDING SWITZERLAND LTD (CH) 2024-03-27 EP claimed
US-20240077837-A1 SYSTEMS AND METHODS FOR INDICATING THE TIME ELAPSED SINCE THE OCCURRENCE OF A TRIGGERING EVENT JOHNSON & JOHNSON VISION CARE (US) 2024-03-07 US claimed
WO-2024038810-A1 POSITIVE-TYPE PHOTOSENSITIVE COMPOSITION, CURED FILM, ORGANIC EL DISPLAY DEVICE, AND COLORANT 東レ株式会社 2024-02-22 WO claimed
EP-3563185-B1 POLARIZING ARTICLE AND METHOD OF FORMING A POLARIZING ARTICLE TRANSITIONS OPTICAL LTD (IE) 2024-01-31 EP claimed
CN-117348276-A Color fixing composition for contact lens, contact lens and lens preparation method 晶硕光学股份有限公司 2024-01-05 CN claimed
US-20240004223-A1 COLOR FIXING COMBINATION FOR CONTACT LENS, CONTACT LENS AND METHOD OF MANUFACTURING THEREOF PEGAVISION CORPORATION (TW) 2024-01-04 US claimed
EP-4299297-A1 COLOR FIXING COMBINATION FOR CONTACT LENS, CONTACT LENS AND METHOD OF MANUFACTURING THEREOF Pegavision Corporation (TW) 2024-01-03 EP claimed
CN-117008238-A Optical polarization device, manufacturing method thereof and near-eye display device 北京字跳网络技术有限公司 2023-11-07 CN claimed
WO-2023195319-A1 POSITIVE PHOTOSENSITIVE PIGMENT COMPOSITION, CURED FILM CONTAINING CURED PRODUCT THEREOF, AND ORGANIC EL DISPLAY DEVICE 東レ株式会社 2023-10-12 WO claimed
US-4568350-A Cold pad-batch process for dyeing silk or silk-containing fiber blends with reactive dyes CIBA-GEIGY CORPORATION (US) 1986-02-04 US claimed
US-4542213-A BLUE COLOR FOR POLYAMIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-09-17 US claimed
US-4532323-A Process for the preparation of triphendioxazine compounds BAYER AKTIENGESELLSCHAFT (DE) 1985-07-30 US claimed
US-4512773-A BLUE DYES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-04-23 US claimed
EP-0135381-A1 Reactive dyes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-03-27 EP claimed
EP-0130711-A2 Aqueous solutions of reactive dyes ICI AMERICAS INC. (US) 1985-01-09 EP claimed
EP-0126026-A1 Process for dyeing silk or silk-containing fibrous material blends CIBA-GEIGY AG (CH) 1984-11-21 EP claimed
EP-0124971-A1 Acid dyes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-11-14 EP claimed
US-4472168-A STORAGE STABILITY BUFFERED SOLUTIONS ICI AMERICAS INC. (US) 1984-09-18 US claimed
US-4116623-A DYEING SYNTHETIC OR CELLULOSE ACETATE FIBERS A BRILLIANT RED MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1978-09-26 US claimed