SCHEMBL7940847

SCHEMBL7940847

[CH2]C(c1ccccc1)C([CH2])c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.47
F2 P00734 1/20 0.47
TSHR P16473 1/20 0.47
HTR2A P28223 1/20 0.43
TAAR1 Q96RJ0 1/20 0.43
CYP2D6 P10635 1/20 0.41
SRC P12931 1/20 0.41
LMNA P02545 2/20 0.39
HRH1 P35367 1/20 0.39
MTOR P42345 1/20 0.39
RAB9A P51151 1/20 0.39
GRM7 Q14831 1/20 0.39
MAPK1 P28482 1/20 0.39
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
MIF P14174 2/20 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
SCHEMBL8813946 0.82 DPP4 (0.39) DPP4F2TSHRHTR2ATAAR1
SCHEMBL1989835 0.82 TSHR (0.46) DPP4F2TSHRTAAR1CYP2D6
SCHEMBL891158 0.82 LMNA (0.44) DPP4TSHRCYP2D6SRCLMNA
SCHEMBL38016 0.81 DPP4 (0.50) DPP4F2TSHRHTR2ATAAR1
SCHEMBL159757 0.80
SCHEMBL1568139 0.80
SCHEMBL6253138 0.80 CES2 (0.41) DPP4F2TSHRHTR2ATAAR1
SCHEMBL794181 0.80 MIF (0.41) DPP4F2TSHRTAAR1CYP2D6
SCHEMBL28995862 0.79 DPP4 (0.47) DPP4F2TSHRHTR2ATAAR1
SCHEMBL832620 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5171852-A Dye cellulose textiles bright reddish blue shades IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-12-15 US claimed
US-6254669-B1 Bleed reduction agents for ink printing inks ZENECA LIMITED (GB) 2001-07-03 US disclosed
EP-0681055-B1 Process for dyeing or printing fibrous material having hydroxyl groups BAYER AG (DE) 2000-08-09 EP disclosed
US-6086955-A Phthalocyanine compounds ZENECA LIMITED (GB) 2000-07-11 US disclosed
EP-0576123-B1 Watersoluble triphenodioxazine dye AVECIA LTD (GB) 2000-03-01 EP disclosed
US-6025486-A CYAN COLORANT FOR INK JET PRINTING INK ZENECA LIMITED (GB) 2000-02-15 US disclosed
US-6015896-A Phthalocyanine compounds ZENECA LIMITED (GB) 2000-01-18 US disclosed
US-5922116-A Phthalocyanine compounds ZENECA LIMITED (GB) 1999-07-13 US disclosed
US-5762652-A COLOR MIXTURES COMPRISING A TRIAZINE DYES AND AN AZO DYES OR A BENZOTRIAZOLE DYES BAYER AKTIENGESELLSCHAFT (DE) 1998-06-09 US disclosed
US-5750689-A Triphendioxazine compounds ZENECA LIMITED (GB) 1998-05-12 US disclosed
EP-0260227-A1 Dioxazine reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1988-03-16 EP disclosed
EP-0144896-B1 TRIPHENDIOXAZINE DYES BAYER AG (DE) 1988-03-16 EP disclosed
EP-0084718-B1 TRIPHENDIOXAZINE DYESTUFFS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1986-04-16 EP disclosed
US-4578461-A Triphendioxazine dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1986-03-25 US disclosed
EP-0144896-A2 Triphendioxazine dyes BAYER AG (DE) 1985-06-19 EP disclosed
US-4512773-A BLUE DYES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-04-23 US disclosed
US-4472575-A Triphendioxazine dyestuffs IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1984-09-18 US disclosed
EP-0101665-A2 Reactive dyestuffs of the dioxazine series, their preparation and their use CIBA-GEIGY AG (CH) 1984-02-29 EP disclosed
EP-0095255-A2 Triphendioxazine dyes, methods for their manufacture and their use for dyeing cellulosic substrates IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-11-30 EP disclosed
EP-0084718-A1 Triphendioxazine dyestuffs IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-08-03 EP disclosed