SCHEMBL6862877

SCHEMBL6862877

C=C(C)C(=O)SCCCC1CS[C@H](c2cccc3ccccc23)S1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
PKM P14618 1/20 0.31
EPHX1 P07099 1/20 0.31
KIF11 P52732 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MAPT P10636 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
SCHEMBL6862881 1.00 MTNR1A (0.34) MTNR1AMTNR1BPKMEPHX1KIF11
SCHEMBL6863193 0.87 MTNR1A (0.37) MTNR1AMTNR1BPKMEPHX1KIF11
SCHEMBL6863128 0.84 CYP1A2 (0.32) MTNR1AMTNR1BPKM
SCHEMBL6863126 0.84 CYP1A2 (0.32) MTNR1AMTNR1BPKM
SCHEMBL6862884 0.83 MTNR1A (0.32) MTNR1AMTNR1BPKM
SCHEMBL6862853 0.82 MTNR1A (0.34) MTNR1AMTNR1BPKMKIF11KDM4E
SCHEMBL6862849 0.82 MTNR1A (0.34) MTNR1AMTNR1BPKMKIF11KDM4E
SCHEMBL6862786 0.81 MTNR1A (0.32) MTNR1AMTNR1B
SCHEMBL6856685 0.78 KDM1A (0.36) MTNR1AMTNR1BKDM4EMAPT
SCHEMBL6856688 0.78 KDM1A (0.36) MTNR1AMTNR1BKDM4EMAPT

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 MTNR1A 4185/4885MTNR1B 4452/4885PKM 2511/4885

“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.