SCHEMBL5677587

SCHEMBL5677587

COC(=O)c1c[c]nc(F)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CA12 O43570 2/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
CA9 Q16790 2/20 0.37
MAPK1 P28482 3/20 0.36
TP53 P04637 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NOTUM Q6P988 2/20 0.35
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 3/20 0.34
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL27435854 0.77 ALOX15 (0.37) KDM4ETDP1LMNA
SCHEMBL8989501 0.76 LMNA (0.36) NPC1RAB9ANOTUMLMNA
SCHEMBL9484919 0.70 MAPK1 (0.42) MAPTNPSR1CA12CA1CA2
SCHEMBL27287238 0.69 MAPT (0.45) MAPTNPSR1MAPK1TP53NPC1
SCHEMBL20969977 0.66 MAPK1 (0.44) MAPTNPSR1CA12CA1CA2
SCHEMBL5675312 0.63
SCHEMBL5675330 0.63 NPSR1 (0.45) MAPTNPSR1RAB9ASMN1; SMN2KDM4E
SCHEMBL23362438 0.63 MAPT (0.46) MAPTNPSR1MAPK1TP53NPC1
SCHEMBL4315950 0.63 MAPT (0.58) MAPTCA12CA1CA2CA9
SCHEMBL29995439 0.63 MAPT (0.58) MAPTCA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100363433-C Metal complex colouring agents based on bucherer naphthols DYSTAR TEXTILFARBEN GMBH & CO (DE) 2008-01-23 CN disclosed
EP-1328588-B1 METAL COMPLEX COLOURING AGENTS BASED ON BUCHERER NAPHTHOLS DYSTAR TEXTILFARBEN GMBH & CO (DE) 2006-01-11 EP disclosed
US-6809187-B2 FIBER REACTIVE COPPER, COBALT OR CHROMIUM CHELATES; LIGHT-FASTNESS; EFFICIENT UNFIXED MATERIAL WASHOFF OYSTAR TEXTIL FARBEN GMBH & CO. (DE) 2004-10-26 US disclosed
US-20040054154-A1 Metal complex dyes based bucherered naphthols DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2004-03-18 US disclosed
CN-1468286-A Metal complex colouring agents based on bucherer naphthols ����־��˹���֯Ʒ��Ⱦ�����Ϲ�˾ 2004-01-14 CN disclosed
EP-1328588-A1 METAL COMPLEX COLOURING AGENTS BASED ON BUCHERER NAPHTHOLS DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2003-07-23 EP disclosed
WO-2002033006-A1 METAL COMPLEX COLOURING AGENTS BASED ON BUCHERER NAPHTHOLS DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2002-04-25 WO disclosed
EP-0828870-B1 SPIN DYEING PROCESS WITH DYEING SALTS DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-02-14 EP disclosed
US-6136970-A COLORFAST FIBER-REACTIVE DYES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-10-24 US disclosed
EP-0735113-B1 Mixtures of reactive dyes and their use CIBA SC HOLDING AG (CH) 2000-10-18 EP disclosed
US-4118382-A DYES FOR CELLULOSE, WOOL, SILK, POLYAMIDE, AND POLYURETHANE FIBERS BAYER AKTIENGESELLSCHAFT (DE) 1978-10-03 US disclosed
US-4089895-A COUPLER FOR AZO DYES BAYER AKTIENGESELLSCHAFT (DT) 1978-05-16 US disclosed
US-4072463-A MONOAZO AND DISAZO DYESTUFFS HOECHST AKTIENGESELLSCHAFT (DT) 1978-02-07 US disclosed
US-4065446-A Reactive dyestuffs containing urea alkylene linkage between chromophore and reactive radical BAYER AKTIENGESELLSCHAFT (DT) 1977-12-27 US disclosed
US-4052386-A REACTIVE PHTHALOCYANINE DYESTUFFS CONTAINING A FLUOROPYRIMIDINYL GROUP BAYER AKTIENGESELLSCHAFT (DT) 1977-10-04 US disclosed
US-4051134-A Reactive dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-09-27 US disclosed
US-4049704-A AZO REACTIVE DYES BAYER AKTIENGESELLSCHAFT (DT) 1977-09-20 US disclosed
US-3989692-A PHTHALOCYANINE DYES, WOOL, SILK, POLYAMIDES, CELLULOSE BAYER AKTIENGESELLSCHAFT (DT) 1976-11-02 US disclosed
US-3988310-A FIBER-REACTIVE DYES; CELLULOSE BAYER AKTIENGESELLSCHAFT (DT) 1976-10-26 US disclosed
US-3957751-A WATER-SOLUBLE REACTIVE DYESTUFFS OF THE MONOAZO SERIES CONTAINING AN ACTIVE METHYLENE COUPLING COMPONENT HOECHST AKTIENGESELLSCHAFT (DT) 1976-05-18 US disclosed