SCHEMBL8087455

SCHEMBL8087455

CCc1ccccc1Nc1n[c]nc(F)n1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.41
P2RX7 Q99572 3/20 0.41
POLB P06746 1/20 0.40
PTK2 Q05397 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CCNB2 O95067 1/20 0.39
CDK1 P06493 1/20 0.39
RET P07949 1/20 0.39
CCNB1 P14635 1/20 0.39
CCNB3 Q8WWL7 1/20 0.39
HTT P42858 2/20 0.38
MAPK14 Q16539 1/20 0.38
PTGS1 P23219 2/20 0.37
TP53 P04637 1/20 0.37
RAB9A P51151 1/20 0.37
PTGS2 P35354 1/20 0.37

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
SCHEMBL8087173 0.83 NPC1 (0.34) POLBRAB9A
SCHEMBL9484073 0.83 GAA (0.46) GAAP2RX7POLBPTK2MEN1
SCHEMBL8092217 0.80 NPC1 (0.46) KMT2AHTTRAB9A
SCHEMBL10910707 0.77 TSHR (0.53) PTK2KMT2ARAB9A
SCHEMBL6547466 0.75 CDC7 (0.52) GAAPOLBPTGS1PTGS2
SCHEMBL4651692 0.73 AURKA (0.45) GAAPTK2MEN1KMT2ACDK1
SCHEMBL4650664 0.71 JAK2 (0.33) PTK2
SCHEMBL1548694 0.71 ALDH1A1 (0.54) GAAPOLBMEN1KMT2APTGS1
SCHEMBL4544859 0.70 KCNH3 (0.51) GAAMEN1KMT2A
SCHEMBL8973755 0.70 TSHR (0.61) GAAP2RX7POLBPTK2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6136970-A COLORFAST FIBER-REACTIVE DYES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-10-24 US disclosed
US-5931975-A TRIAZINE REACTIVE DYES CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-08-03 US disclosed
US-5892006-A CONTAINING S-TRIAZINE RINGS CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-04-06 US disclosed
US-5735911-A TRIAZINE DYES HAVING GOOD WET AND LIGHT FASTNESS PROPERTIES CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-04-07 US disclosed
EP-0472975-B1 Asymmetric dioxazine compounds and method for dyeing or printing fiber materials using the same SUMITOMO CHEMICAL CO (JP) 1997-12-17 EP disclosed
US-5684138-A Asymmetrical reactive dyes containing two triazinyl radicals which are bridged via an aliphatic bridge member CIBA SPECIALTY CHEMICALS CORPORATION (US) 1997-11-04 US disclosed
US-5612463-A AMINOTRIAZINE DYES CIBA-GEIGY CORPORATION (US) 1997-03-18 US disclosed
EP-0541084-B1 Asymmetric dioxazine compounds and method for dyeing or printing fiber materials using the same SUMITOMO CHEMICAL CO (JP) 1997-02-26 EP disclosed
US-5552532-A Reactive dyes, processes for their preparation and their use CIBA-GEIGY CORPORATION (US) 1996-09-03 US disclosed
US-5490866-A MIXTURE OF POLYVINYLPYRROLIDONE AND ALKALI SILICATE CIBA-GEIGY CORPORATION (US) 1996-02-13 US disclosed
US-4777247-A Heavy metal-containing monoazo dyes BAYER AKTIENGESELLSCHAFT (DE) 1988-10-11 US disclosed
US-4772687-A AZO DYES, COLORFAST BAYER AKTIENGESELLSCHAFT (DE) 1988-09-20 US disclosed
US-4665179-A FIBER-REACTIVE DYES BAYER AKTIENGESELLSCHAFT (DE) 1987-05-12 US disclosed
US-4659806-A WASH-AND COLORFASTNESS BAYER AKTIENGESELLSCHAFT (DE) 1987-04-21 US disclosed
US-4638054-A Aminonaphthol bisazo reactive dyes BAYER AKTIENGESELLSCHAFT (DE) 1987-01-20 US disclosed
US-4622396-A FIBER REACTIVE DYES BAYER AKTIENGESELLSCHAFT (DE) 1986-11-11 US disclosed
US-4621138-A Triphendioxazine dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1986-11-04 US disclosed
US-4591643-A Triphendioxazine reactive dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1986-05-27 US disclosed
US-4556707-A DYEING CELLULOSE FIBERS AND POLYAMIDE FIBERS BAYER AKTIENGESELLSCHAFT (DE) 1985-12-03 US disclosed
US-4460505-A Dyestuffs, processes for their preparation and their use for dyeing materials containing hydroxyl groups or nitrogen BAYER AKTIENGESELLSCHAFT (DE) 1984-07-17 US disclosed