SCHEMBL16285083

SCHEMBL16285083

C=CC(=O)N(CCCOC)CCCOC

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 2/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
ALDH1A1 P00352 4/20 0.36
TSHR P16473 3/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
CYP3A4 P08684 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP8 P22894 1/20 0.31
RECQL P46063 1/20 0.30

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
SCHEMBL16285081 0.94 ZDHHC20 (0.46) ZDHHC20ZDHHC2ALDH1A1TSHRHPGD
SCHEMBL6929537 0.88 ZDHHC20 (0.43) ZDHHC20ZDHHC2ALDH1A1TSHRHPGD
SCHEMBL16285095 0.81 ALDH1A1 (0.45) ZDHHC20ZDHHC2ALDH1A1TSHRHPGD
SCHEMBL5746411 0.81 ZDHHC20 (0.46) ZDHHC20ZDHHC2ALDH1A1TSHRHPGD
SCHEMBL6931427 0.78 ZDHHC20 (0.43) ZDHHC20ZDHHC2ALDH1A1TSHRHPGD
SCHEMBL16285076 0.77 TSHR (0.50) ZDHHC20ZDHHC2ALDH1A1TSHRRECQL
SCHEMBL345353 0.77 ZDHHC20 (0.61) ZDHHC20ZDHHC2ALDH1A1TSHRHPGD
SCHEMBL12433200 0.76 ALDH1A1 (0.43) ALDH1A1TSHRMAPK1HDAC1HDAC6
SCHEMBL4316811 0.76 ZDHHC20 (0.41) ZDHHC20ZDHHC2
SCHEMBL16285074 0.76 ZDHHC20 (0.44) ZDHHC20ZDHHC2ALDH1A1TSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170137644-A1 INK, INK CARTRIDGE, INK JET RECORDING DEVICE, INK JET INK PRINTED MATTER, COMPOUND, AND COMPOSITION MORITA MITSUNOBU (JP) 2017-05-18 US disclosed
US-9593248-B2 Ink, ink cartridge, ink jet recording device, ink jet ink printed matter, compound, and composition RICOH COMPANY, LTD. (JP) 2017-03-14 US disclosed
US-20140363634-A1 INK, INK CARTRIDGE, INK JET RECORDING DEVICE, INK JET INK PRINTED MATTER, COMPOUND, AND COMPOSITION RICOH COMPANY, LTD. (JP) 2014-12-11 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-20140363634-A1 INK, INK CARTRIDGE, INK JET RECORDING DEVICE, INK JET INK PRINTED MATTER, COMPOUND, AND COMPOSITION CDKN1A, MAPK9, SFRP1 ZDHHC20 4289/4885ZDHHC2 4661/4885ALDH1A1 883/4885

“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.