SCHEMBL12227198

SCHEMBL12227198

C=C(C)c1ccc(OCC2CCC(COc3ccc(C(=C)C)cc3)CC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PARP15 Q460N3 4/20 0.60
▸ PARP10 Q53GL7 4/20 0.60
▸ PARP2 Q9UGN5 2/20 0.60
▸ TDP1 Q9NUW8 1/20 0.46
▸ NR1H4 Q96RI1 1/20 0.44
▸ ACACB O00763 2/20 0.43

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
SCHEMBL12227196 0.87 PARP15 (0.55) PARP15PARP10PARP2TDP1
SCHEMBL573380 0.84 PARP15 (0.44) PARP15PARP10PARP2NR1H4
SCHEMBL2087536 0.82 PARP15 (0.70) PARP15PARP10PARP2NR1H4ACACB
SCHEMBL29024848 0.80 PARP15 (0.64) PARP15PARP10PARP2TDP1
SCHEMBL573700 0.79 ALDH1A1 (0.57) TDP1
SCHEMBL2665020 0.79 PARP15 (0.55) PARP15PARP10PARP2TDP1
SCHEMBL8930160 0.79 PARP15 (0.55) PARP15PARP10PARP2TDP1
Methane SCHEMBL10903317 0.78 ALDH1A1 (0.55) TDP1
Ammonia Solution, Strong SCHEMBL28413630 0.77 PARP15 (0.53) PARP15PARP10PARP2TDP1
SCHEMBL18905505 0.77 L3MBTL1 (0.42) PARP10TDP1

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-8043534-B2 An adhesive comprising a maleimide and an aromatic diene or an aromatic monoene which cure to form useful thermosetting resins for the microelectronic packaging industry; semiconcuctor dies; addition polymerization/Diels-Alder reaction; heat and acid resistance; toughness; noncracking; nondestructive DESIGNER MOLECULES, INC. (US) 2011-10-25 — — US disclosed
US-8043534-B2 An adhesive comprising a maleimide and an aromatic diene or an aromatic monoene which cure to form useful thermosetting resins for the microelectronic packaging industry; semiconcuctor dies; addition polymerization/Diels-Alder reaction; heat and acid resistance; toughness; noncracking; nondestructive DESIGNER MOLECULES, INC. (US) 2011-10-25 — — US disclosed
US-20080075965-A1 Maleimide compositions and methods for use thereof DESIGNER MOLECULES, INC. 2008-03-27 — — US disclosed
US-20080075965-A1 Maleimide compositions and methods for use thereof DESIGNER MOLECULES, INC. 2008-03-27 — — 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-20080075965-A1 Maleimide compositions and methods for use thereof KDM4E, MLLT1, DOT1L PARP15 13/4885PARP10 30/4885PARP2 245/4885

“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.

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