SCHEMBL416649

SCHEMBL416649

NC(=O)CCCCCCCCC#CC#CCCCCCCCCC(=O)O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HMGCR P04035 7/20 0.69
▸ PTPN7 P35236 5/20 0.63
▸ MAPT P10636 2/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ CYP2D6 P10635 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ LMNA P02545 3/20 0.50
▸ TSHR P16473 1/20 0.50
▸ NFKB1 P19838 1/20 0.50
▸ PMP22 Q01453 1/20 0.50
▸ RECQL P46063 3/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ PLG P00747 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ ALOX15 P16050 1/20 0.46

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
SCHEMBL1918468 0.92 HMGCR (0.65) HMGCRPTPN7MAPTCYP1A2CYP2D6
SCHEMBL2553133 0.91 HMGCR (0.80) HMGCRPTPN7MAPTCYP1A2CYP2D6
SCHEMBL414271 0.91 HMGCR (0.80) HMGCRPTPN7MAPTCYP1A2CYP2D6
SCHEMBL411385 0.91 HMGCR (0.80) HMGCRPTPN7MAPTCYP1A2CYP2D6
SCHEMBL410681 0.91 HMGCR (0.80) HMGCRPTPN7MAPTCYP1A2CYP2D6
SCHEMBL416648 0.91 HMGCR (0.55) HMGCRPTPN7MAPTCYP1A2CYP2D6
SCHEMBL11139452 0.91 HMGCR (0.80) HMGCRPTPN7MAPTCYP1A2CYP2D6
SCHEMBL10481605 0.91 HMGCR (0.55) HMGCRPTPN7MAPTCYP1A2CYP2D6
SCHEMBL416646 0.91 HMGCR (0.80) HMGCRPTPN7MAPTCYP1A2CYP2D6
SCHEMBL8763744 0.91 HMGCR (0.80) HMGCRPTPN7MAPTCYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2331751-B1 LASER IMAGEABLE PAPER DATALASE LTD (GB) 2017-07-26 — — EP disclosed
US-9017425-B2 Textile colouration DATALASE LTD. (GB) 2015-04-28 — — US disclosed
EP-2332012-B1 ENERGY ACTIVATED COMPOSITIONS DATALASE LTD (GB) 2014-07-09 — — EP disclosed
US-8663902-B2 Laser imaging DATALASE LTD (GB) 2014-03-04 — — US disclosed
US-8637114-B2 Laser imageable paper DATALASE LTD (GB) 2014-01-28 — — US disclosed
US-8557510-B2 Colour forming composition DATALASE LTD. (GB) 2013-10-15 — — US disclosed
EP-2329425-B1 MULTI-COLOURED CODES DATALASE LTD (GB) 2013-07-31 — — EP disclosed
US-8420282-B2 Filters DATALASE LTD (GB) 2013-04-16 — — US disclosed
US-8398760-B2 Energy activated compositions DATALASE LTD. (GB) 2013-03-19 — — US disclosed
EP-2304503-B1 Method for producing a filter DATALASE LTD (GB) 2013-01-09 — — EP disclosed
WO-2010112940-A1 LASER IMAGING DATALASE LTD. (GB) 2010-10-07 — — WO disclosed
WO-2010089595-A1 CO-CRYSTALS AND THEIR USE DATALASE LTD. (GB) 2010-08-12 — — WO disclosed
WO-2010029331-A2 COLOUR FORMING COMPOSITION DATALASE LTD. (GB) 2010-03-18 — — WO disclosed
WO-2010029328-A2 TEXTILE COLOURATION DATALASE LTD. (GB) 2010-03-18 — — WO disclosed
WO-2010029332-A1 MULTI-COLOURED CODES DATALASE LTD. (GB) 2010-03-18 — — WO disclosed
WO-2010029327-A1 DATA STORAGE MEDIUM DATALASE LTD. (GB) 2010-03-18 — — WO disclosed
WO-2010029330-A1 WATER-SOLUBLE CAPSULE DATALASE LTD. (GB) 2010-03-18 — — WO disclosed
WO-2010029329-A1 ENERGY ACTIVATED COMPOSITIONS DATALASE LTD. (GB) 2010-03-18 — — WO disclosed
WO-2010026408-A2 LASER IMAGEABLE PAPER DATALASE LTD. (GB) 2010-03-11 — — WO disclosed
WO-2010001172-A1 FILTERS DATALASE LTD (GB) 2010-01-07 — — WO disclosed
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