SCHEMBL3080867

SCHEMBL3080867

C=C(C(=O)OCCCC)C(O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.53
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.47
ATM Q13315 1/20 0.45
HCAR2 Q8TDS4 1/20 0.40
NAAA Q02083 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RAD52 P43351 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ESR1 P03372 2/20 0.38
EPHX1 P07099 1/20 0.37
THRB P10828 1/20 0.37
FAAH O00519 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37
MAPK1 P28482 1/20 0.37
CYP2C19 P33261 1/20 0.37
NR1H2 P55055 1/20 0.37

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
SCHEMBL1593009 0.88 TSHR (0.42) TSHRALDH1A1HPGDATMHCAR2
SCHEMBL5248798 0.86 TSHR (0.52) TSHRALDH1A1HPGDATMHCAR2
SCHEMBL7123449 0.86 TSHR (0.52) TSHRALDH1A1HPGDATMHCAR2
SCHEMBL10652696 0.85 TSHR (0.50) TSHRALDH1A1HPGDATMHCAR2
SCHEMBL6200579 0.84 TSHR (0.53) TSHRALDH1A1HPGDATMHCAR2
SCHEMBL5252175 0.83 TSHR (0.49) TSHRALDH1A1HPGDATMHCAR2
SCHEMBL4425664 0.83 TSHR (0.49) TSHRALDH1A1HPGDATMHCAR2
SCHEMBL9747388 0.82 TSHR (0.52) TSHRALDH1A1HPGDATMHCAR2
SCHEMBL9745490 0.82 TSHR (0.52) TSHRALDH1A1HPGDATMHCAR2
SCHEMBL9745135 0.82 TSHR (0.52) TSHRALDH1A1HPGDATMHCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242205-B2 Water dispersions of non-uniform polyurethane particles LUBRIZOL ADVANCED MATERIALS, INC. (US) 2012-08-14 US disclosed
EP-1484366-B1 TREATED PIGMENT, USE THEREOF, AND COMPOUND FOR TREATING PIGMENT SAKATA INX CORP (JP) 2012-07-25 EP disclosed
CN-101775207-B Optical direct writing patterned organic thin film transistor insulating layer material UNIV JILIN 2011-08-03 CN disclosed
EP-1639025-B1 WATER DISPERSIONS OF CORE-SHELL POLYURETHANES LUBRIZOL ADVANCED MAT INC (US) 2010-10-13 EP disclosed
CN-101775207-A Optical direct writing patterned organic thin film transistor insulating layer material UNIV JILIN 2010-07-14 CN disclosed
US-20100048765-A1 Water Dispersions Of Non-Uniform Polyurethane Particles LUBRIZOL ADVANCED MATERIALS, INC. (US) 2010-02-25 US disclosed
US-7582698-B2 Water dispersions of non-uniform polyurethane particles LUBRIZOL ADVANCED MATERIALS, INC. (US) 2009-09-01 US disclosed
US-20090073355-A1 COLOR FILTER INK, COLOR FILTER, IMAGE DISPLAY DEVICE, AND ELECTRONIC DEVICE SEIKO EPSON CORPORATION (JP) 2009-03-19 US disclosed
US-20080281036-A1 Pigment Dispersion Composition, Use Thereof And Compound For Treating Pigment SAKATA INX CORP. (JP) 2008-11-13 US disclosed
US-7252710-B2 Pigment dispersion composition, use thereof and compound for pigment treatment SAKATA INX CORP. (JP) 2007-08-07 US disclosed
US-7220306-B2 Treated pigment, use thereof, and compound for treating pigment SAKATA INK CORP. (JP) 2007-05-22 US disclosed
EP-1777274-A1 PIGMENT DISPERSION COMPOSITION, USE THEREOF AND COMPOUND FOR TREATING PIGMENT Sakata Inx Corporation (JP) 2007-04-25 EP disclosed
EP-1639025-A1 WATER DISPERSIONS OF CORE-SHELL POLYURETHANES Noveon IP Holdings Corp. (US) 2006-03-29 EP disclosed
US-20050284335-A1 for producing black matrices having high insulating characteristics and color filters having high transmissivity and high contrast, excellent in developing characteristics; consisting of a pigment derivative, pigment intermediate, colorant derivative and intermediate each reactive with a carbodiimide SAKATA INX CORP. (JP) 2005-12-29 US disclosed
US-20050204959-A1 Treated pigment, use thereof, and compound for treating pigment HOMER E. HUNNICUTT JR. OF PAR ACAUISITIONS, LLC 2005-09-22 US disclosed
WO-2005005506-A1 WATER DISPERSIONS OF CORE-SHELL POLYURETHANES NOVEON IP HOLDINGS CORP. (US) 2005-01-20 WO disclosed
US-20050004306-A1 Water dispersions of non-uniform polyurethane particles LUBRIZOL ADVANCED MATERIALS, INC. 2005-01-06 US disclosed
EP-1484366-A1 TREATED PIGMENT, USE THEREOF, AND COMPOUND FOR TREATING PIGMENT Sakata Inx Corporation (JP) 2004-12-08 EP disclosed
US-6211286-B1 Binders for soft feel coating materials SOLUTIA AUSTRIA GMBH (AT) 2001-04-03 US 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 (1 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-20050284335-A1 for producing black matrices having high insulating characteristics and color filters having high transmissivity and high contrast, excellent in developing characteristics; consisting of a pigment derivative, pigment intermediate, colorant derivative and intermediate each reactive with a carbodiimide IK, RB1, PIGS TSHR 2921/4885ALDH1A1 685/4885HPGD 633/4885

“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.