SCHEMBL514084

SCHEMBL514084

C=CCCCCCC(=O)OCCCC

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.62
DGKA P23743 2/20 0.61
ALDH1A1 P00352 2/20 0.61
LMNA P02545 1/20 0.61
DNM1 Q05193 1/20 0.51
HPGD P15428 1/20 0.50
MGLL Q99685 1/20 0.49
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
MAPT P10636 2/20 0.48
ABCC4 O15439 1/20 0.48
ATM Q13315 1/20 0.48
THRB P10828 1/20 0.48
CNR1 P21554 1/20 0.48
PAM P19021 2/20 0.47
NAAA Q02083 1/20 0.47
HTR2C P28335 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
SCHEMBL14763919 1.00 TSHR (0.62) TSHRDGKAALDH1A1LMNADNM1
SCHEMBL12803469 1.00 TSHR (0.62) TSHRDGKAALDH1A1LMNADNM1
SCHEMBL858498 1.00 TSHR (0.62) TSHRDGKAALDH1A1LMNADNM1
SCHEMBL515244 1.00 TSHR (0.62) TSHRDGKAALDH1A1LMNADNM1
SCHEMBL3123509 1.00 TSHR (0.62) TSHRDGKAALDH1A1LMNADNM1
SCHEMBL12804186 1.00 TSHR (0.62) TSHRDGKAALDH1A1LMNADNM1
SCHEMBL12803459 1.00 TSHR (0.62) TSHRDGKAALDH1A1LMNADNM1
SCHEMBL3111539 1.00 TSHR (0.62) TSHRDGKAALDH1A1LMNADNM1
SCHEMBL514530 0.98 TSHR (0.59) TSHRDGKAALDH1A1LMNADNM1
SCHEMBL8662579 0.95 TSHR (0.65) TSHRDGKAALDH1A1LMNADNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8790424-B2 Copolymer and use thereof for improving the cold flow properties of middle distillate fuels BASF SE (DE) 2014-07-29 US disclosed
EP-2415740-B1 METHOD FOR PRODUCING HIGH-PURITY TERMINAL OLEFIN COMPOUND KURARAY CO (JP) 2013-12-25 EP disclosed
US-8609886-B2 Method for producing high purity terminal olefin compound KURARAY CO., LTD. (JP) 2013-12-17 US disclosed
US-20120247001-A1 COPOLYMER AND USE THEREOF FOR IMPROVING THE COLD FLOW PROPERTIES OF MIDDLE DISTILLATE FUELS BASF SE (DE) 2012-10-04 US disclosed
EP-2415740-A1 METHOD FOR PRODUCING HIGH-PURITY TERMINAL OLEFIN COMPOUND Kuraray Co., Ltd. (JP) 2012-02-08 EP disclosed
US-20120029229-A1 METHOD FOR PRODUCING HIGH PURITY TERMINAL OLEFIN COMPOUND KURARAY CO., LTD. (JP) 2012-02-02 US disclosed
EP-1734061-B1 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer and uses thereof MITSUI CHEMICALS INC (JP) 2010-04-07 EP disclosed
US-7393907-B2 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof MITSUI CHEMICALS, INC. (JP) 2008-07-01 US disclosed
EP-1734061-A2 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer and uses thereof MITSUI CHEMICALS, INC. (JP) 2006-12-20 EP disclosed
US-20040122192-A1 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof MITSUI CHEMICALS, INC. 2004-06-24 US disclosed
US-20020156207-A1 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof MITSUI CHEMICALS, INC. (JP) 2002-10-24 US disclosed
EP-1186619-A2 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition contaning the copolymer, and uses thereof Mitsui Chemicals, Inc. (JP) 2002-03-13 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120029229-A1 METHOD FOR PRODUCING HIGH PURITY TERMINAL OLEFIN COMPOUND ADH1A, ADH1C, OSBP TSHR 3218/4885DGKA 545/4885ALDH1A1 233/4885
US-20120247001-A1 COPOLYMER AND USE THEREOF FOR IMPROVING THE COLD FLOW PROPERTIES OF MIDDLE DISTILLATE FUELS ADH1A, ADH5, ADH1C TSHR 4405/4885DGKA 337/4885ALDH1A1 274/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.