SCHEMBL339506

SCHEMBL339506

C=Cc1cc(C(N)=O)ccc1OC(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 1/20 0.50
IRAK4 Q9NWZ3 2/20 0.44
TOP2A P11388 2/20 0.41
POLB P06746 2/20 0.40
MAPK1 P28482 1/20 0.40
PDE4B Q07343 3/20 0.39
PDE4A P27815 2/20 0.39
PDE4C Q08493 2/20 0.39
PDE4D Q08499 2/20 0.39
ALDH1A1 P00352 3/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
ALOX12 P18054 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PDK1 Q15118 1/20 0.38
KMT2A Q03164 1/20 0.37
TSHR P16473 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36

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
SCHEMBL340676 0.88 TSHR (0.43) PARP10PDE4BPDE4APDE4CPDE4D
SCHEMBL8327603 0.86 PARP10 (0.51) PARP10IRAK4TOP2APOLBMAPK1
SCHEMBL339283 0.86 ALDH1A1 (0.49) POLBPDE4BPDE4APDE4CPDE4D
SCHEMBL31372250 0.86 KMT2A (0.49) MAPK1ALDH1A1LMNAHTTPDK1
SCHEMBL18360184 0.86 KMT2A (0.49) MAPK1ALDH1A1LMNAHTTPDK1
SCHEMBL18360185 0.84 HDAC1 (0.42) POLBMAPK1ALDH1A1MAPTHTT
SCHEMBL340328 0.84 MAPT (0.44) MAPK1ALDH1A1LMNAMAPTALOX12
SCHEMBL340375 0.81 ELANE (0.51) MAPK1ALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL7325813 0.80 PARP10 (0.59) PARP10IRAK4TOP2APOLBMAPK1
SCHEMBL3827746 0.78 P2RX3 (0.41) IRAK4POLBLMNAKMT2ATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8288576-B2 Recyclable ruthenium catalysts for metathesis reactions ZANNAN SCITECH CO., LTD. (CN) 2012-10-16 US disclosed
US-20120016093-A1 RECYCLABLE RUTHENIUM CATALYSTS FOR METATHESIS REACTIONS ZANNAN SCITECH CO., LTD. (CN) 2012-01-19 US disclosed
US-8049025-B2 Recyclable ruthenium catalysts for metathesis reactions ZANNAN SCITECH CO., LTD. (CN) 2011-11-01 US disclosed
US-20100041844-A1 RECYCLABLE RUTHENIUM CATALYSTS FOR METATHESIS REACTIONS ZHENG-YUN JAMES ZHAN (CN) 2010-02-18 US disclosed
US-7632772-B2 Recyclable ruthenium catalysts for metathesis reactions Zhan, Zheng-Yun James (CN) 2009-12-15 US disclosed
US-20070043180-A1 Recyclable ruthenium catalysts for metathesis reactions ZHENG-YUN JAMES ZHAN (CN) 2007-02-22 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 (3 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-20120016093-A1 RECYCLABLE RUTHENIUM CATALYSTS FOR METATHESIS REACTIONS RPIA, REV1, RCSD1 PARP10 340/4885IRAK4 1573/4885TOP2A 3386/4885
US-20100041844-A1 RECYCLABLE RUTHENIUM CATALYSTS FOR METATHESIS REACTIONS RPIA, REV1, RCSD1 PARP10 340/4885IRAK4 1573/4885TOP2A 3386/4885
US-20070043180-A1 Recyclable ruthenium catalysts for metathesis reactions RPIA, REV1, RCSD1 PARP10 340/4885IRAK4 1573/4885TOP2A 3386/4885

“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.