SCHEMBL514878

SCHEMBL514878

C=CCCC(=O)CCCC

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
ALDH1A1 P00352 4/20 0.50
MAPT P10636 2/20 0.45
KMT2A Q03164 1/20 0.45
CES1 P23141 2/20 0.44
CES2 O00748 1/20 0.44
FAAH O00519 3/20 0.41
TP53 P04637 1/20 0.41
ABCC4 O15439 1/20 0.40
LMNA P02545 1/20 0.39
CA1 P00915 1/20 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
SCHEMBL14654918 0.93 MAPT (0.54) TSHRALDH1A1MAPTKMT2ACES1
SCHEMBL28812563 0.91 TSHR (0.46) TSHRALDH1A1MAPTKMT2ACES1
SCHEMBL11743168 0.91 MAPT (0.57) TSHRMAPTKMT2ACES1CES2
SCHEMBL9345659 0.91 MAPT (0.57) TSHRMAPTKMT2ACES1CES2
SCHEMBL17629047 0.91 MAPT (0.57) TSHRMAPTKMT2ACES1CES2
SCHEMBL11745435 0.91 MAPT (0.57) TSHRMAPTKMT2ACES1CES2
SCHEMBL10734584 0.91 MAPT (0.57) TSHRMAPTKMT2ACES1CES2
SCHEMBL11740658 0.91 MAPT (0.57) TSHRMAPTKMT2ACES1CES2
SCHEMBL11749087 0.91 MAPT (0.57) TSHRMAPTKMT2ACES1CES2
SCHEMBL515402 0.91 TSHR (0.56) TSHRALDH1A1MAPTKMT2ACES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-56120681-A None JP disclosed
US-20230096312-A1 RESIST COMPOSITION AND METHOD FOR USING RESIST COMPOSITION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2023-03-30 US disclosed
US-9714271-B2 Cyclosporine analogue molecules modified at amino acid 1 and 3 CONTRAVIR PHARMACEUTICALS, INC. (US) 2017-07-25 US disclosed
US-20160207961-A1 Cyclosporine Analogue Molecules Modified At Amino Acid 1 and 3 ACHILLE LIFE SCIENCES LIMITED (GB) 2016-07-21 US disclosed
US-9200038-B2 Cyclosporine analogue molecules modified at amino acid 1 and 3 CICLOFILIN PHARMACEUTICALS CORP. (CA) 2015-12-01 US disclosed
CN-102369173-B Method for producing high-purity terminal olefin compound KURARAY CO 2014-09-10 CN disclosed
US-20140142033-A1 CYCLOSPORINE ANALOGUE MOLECULES MODIFIED AT AMINO ACID 1 AND 3 ISOTECHNIKA PHARMA INC. (CA) 2014-05-22 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-20130190223-A1 NONIMMUNOSUPPRESSIVE CYCLOSPORINE ANALOGUE MOLECULES ISOTECHNIKA PHARMA INC. (CA) 2013-07-25 US disclosed
EP-1694803-B1 HYDROPHOBIC MODIFIED DIQUATERNARY MONOMERS AND POLYMERS AS THICKENING AGENTS OF ACIDIC AQUEOUS COMPOSITIONS RHODIA (US) 2013-04-10 EP 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
JP-S56120681-A PREPARATION OF (Z)-8-NONEN-5-ONE DERIVATIVE SAGAMI CHEM RES CENTER 1981-09-22 JP 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 (4 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-20130190223-A1 NONIMMUNOSUPPRESSIVE CYCLOSPORINE ANALOGUE MOLECULES CD40, FKBP1A, FKBP4 TSHR 2593/4885ALDH1A1 2494/4885MAPT 4681/4885
US-20160207961-A1 Cyclosporine Analogue Molecules Modified At Amino Acid 1 and 3 FKBP1A, CHP1, FKBP3 TSHR 4502/4885ALDH1A1 3240/4885MAPT 3843/4885
US-20140142033-A1 CYCLOSPORINE ANALOGUE MOLECULES MODIFIED AT AMINO ACID 1 AND 3 FKBP1A, CHP1, FKBP3 TSHR 4502/4885ALDH1A1 3240/4885MAPT 3843/4885
US-20120029229-A1 METHOD FOR PRODUCING HIGH PURITY TERMINAL OLEFIN COMPOUND ADH1A, ADH1C, OSBP TSHR 3218/4885ALDH1A1 233/4885MAPT 1768/4885

“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.