SCHEMBL6862856

SCHEMBL6862856

CC=CC(=O)OCCCC1CSC(c2cccc3ccccc23)S1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
GSTP1 P09211 1/20 0.32
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
ABCB1 P08183 7/20 0.32
ABCG2 Q9UNQ0 4/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
RCE1 Q9Y256 1/20 0.31
EGFR P00533 1/20 0.31
ERBB2 P04626 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
SCHEMBL6863118 0.89 THRB (0.36) PKMHRH3MTNR1AMTNR1B
SCHEMBL6863117 0.89 THRB (0.36) PKMHRH3MTNR1AMTNR1B
SCHEMBL6862853 0.84 MTNR1A (0.34) PKMHRH3MTNR1AMTNR1BMEN1
SCHEMBL6862849 0.84 MTNR1A (0.34) PKMHRH3MTNR1AMTNR1BMEN1
SCHEMBL6862884 0.83 MTNR1A (0.32) PKMMTNR1AMTNR1B
SCHEMBL6856688 0.78 KDM1A (0.36) MTNR1AMTNR1B
SCHEMBL6856685 0.78 KDM1A (0.36) MTNR1AMTNR1B
SCHEMBL6862987 0.75 PKM (0.34) PKMMTNR1AMTNR1BMEN1KMT2A
SCHEMBL6856078 0.75 SLC6A4 (0.36) MTNR1A
SCHEMBL6863128 0.74 CYP1A2 (0.32) PKMMTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6794471-B2 OF A HYDROXYHYDROCARBYL- OR MERCAPTOHYDROCARBYL- DITHIOLANE; CURED OPTICAL ARTICLE FORMED BY PHOTOPOLYMERIZING THE ACRYLATE MITSUI CHEMICALS, INC. (JP) 2004-09-21 US disclosed
EP-1193264-B1 Acrylic ester compound and usage thereof MITSUI CHEMICALS INC (JP) 2004-03-31 EP disclosed
US-20020061995-A1 Acrylic ester compound and usage thereof MITSUI CHEMICALS, INC. (JP) 2002-05-23 US disclosed
EP-1193264-A1 Acrylic ester compound and usage thereof Mitsui Chemicals, Inc. (JP) 2002-04-03 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 (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-20020061995-A1 Acrylic ester compound and usage thereof ASS1, HAT1, EIF2B1 PKM 2511/4885HRH3 542/4885GSTP1 2058/4885

“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.