SCHEMBL10085537

SCHEMBL10085537

C=CC(=O)OC(CCC1CCCC1)CC(C)C

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
BCHE P06276 1/20 0.34
METAP2 P50579 1/20 0.33
METAP1 P53582 1/20 0.33
KLK7 P49862 3/20 0.32
CTSL P07711 2/20 0.31
CTSB P07858 2/20 0.31
CTSK P43235 2/20 0.31
CTSH P09668 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL14413242 0.82 TSHR (0.37) TSHRMETAP2METAP1KLK7CTSL
SCHEMBL13890233 0.80 TSHR (0.37) TSHRBCHEMETAP2METAP1KLK7
SCHEMBL10085532 0.80 TSHR (0.44) TSHRBCHEMETAP2
SCHEMBL14265520 0.79 BCHE (0.34) BCHEMETAP2METAP1KLK7CTSL
SCHEMBL27477306 0.78 TSHR (0.52) TSHRCTSK
SCHEMBL10085535 0.78 USP2 (0.40) TSHRTDP1
SCHEMBL23494037 0.77 TSHR (0.44) TSHRCTSK
SCHEMBL27646470 0.76 CTSK (0.36) TSHRCTSKTDP1
SCHEMBL23794924 0.74 CTSK (0.49) TSHRCTSK
SCHEMBL10085533 0.74 METAP1 (0.33) BCHEMETAP2METAP1CTSLCTSB

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8158212-B2 Ink composition, inkjet recording method, and printed material FUJIFILM CORPORATION (JP) 2012-04-17 US disclosed
US-8053169-B2 an N-vinylcaptrolactam; a polymerization initiator; and organic amine compounds as light stabilizers; curing FUJIFILM CORPORATION (JP) 2011-11-08 US disclosed
US-20090244116-A1 INKJET RECORDING METHOD AND INKJET RECORDING SYSTEM FUJIFILM CORPORATION (JP) 2009-10-01 US disclosed
US-20090202795-A1 INK COMPOSITION, INKJET RECORDING METHOD, PRINTED MATERIAL, AND MOLDED PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2009-08-13 US disclosed
US-20080286484-A1 INK COMPOSITION, INKJET RECORDING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2008-11-20 US disclosed
US-20080063981-A1 Ink composition, inkjet recording method, printed material, and process for producing lithographic printing plate FUJIFILM CORPORATION (JP) 2008-03-13 US disclosed