SCHEMBL15969067

SCHEMBL15969067

O=C(OCC1CC1)c1ccc(OCC2CC2)s1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARP15 Q460N3 4/20 0.40
PARP10 Q53GL7 4/20 0.40
PARP2 Q9UGN5 2/20 0.40
JMJD6 Q6NYC1 2/20 0.37
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
RECQL P46063 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ADORA2B P29275 4/20 0.36
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
DRD2 P14416 1/20 0.33
DRD4 P21917 1/20 0.33
PTGIR P43119 1/20 0.33

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
SCHEMBL15134641 0.93 PARP10 (0.43) PARP15PARP10PARP2LMNAPOLB
SCHEMBL11660279 0.86 LMNA (0.39) JMJD6LMNAPOLBRECQLL3MBTL1
SCHEMBL15968070 0.84 PARP15 (0.41) PARP15PARP10PARP2
SCHEMBL11655346 0.84 TSHR (0.40) LMNAPOLB
SCHEMBL11661811 0.79 ALDH1A1 (0.51) POLBL3MBTL1HDAC3HDAC4HDAC1
SCHEMBL11658018 0.76 L3MBTL1 (0.38) JMJD6LMNAPOLBRECQLL3MBTL1
SCHEMBL11654868 0.75 CASP3 (0.53) LMNAPOLBL3MBTL1
SCHEMBL15129126 0.73 ALDH1A1 (0.48) LMNAPOLBRECQLL3MBTL1
SCHEMBL11664027 0.72 BCL2L1 (0.51) L3MBTL1HDAC3HDAC4HDAC1HDAC6
SCHEMBL11656364 0.71 NPC1 (0.53) LMNAL3MBTL1ADORA2B

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-9133129-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-15 US disclosed
EP-2772485-A1 BICYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-09-03 EP disclosed
US-20140243310-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-08-28 US disclosed
CN-103998432-A Bicyclic compounds TAKEDA PHARMACEUTICAL 2014-08-20 CN 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-20140243310-A1 BICYCLIC COMPOUND BICRA, NR3C2, CYP11B2 PARP15 1936/4885PARP10 3280/4885PARP2 4063/4885

“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.