SCHEMBL340328

SCHEMBL340328

C=Cc1cc(C(=O)OC)ccc1OC(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
CA12 O43570 2/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA7 P43166 2/20 0.42
CA9 Q16790 2/20 0.42
CA14 Q9ULX7 2/20 0.42
XDH P47989 1/20 0.42
ALDH1A1 P00352 6/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 3/20 0.40
USP2 O75604 1/20 0.40
MEN1 O00255 2/20 0.40
P2RX3 P56373 1/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
CASP1 P29466 1/20 0.40

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
SCHEMBL5167967 0.88 MAPT (0.48) MAPTCA12CA1CA2CA7
SCHEMBL31405388 0.87 MAPT (0.46) MAPTCA12CA1CA2CA7
SCHEMBL2593180 0.87 ERN1 (0.48) MAPTCA12CA1CA2CA7
SCHEMBL340676 0.86 TSHR (0.43) ALDH1A1KMT2AUSP2HSD17B10GAA
SCHEMBL31372250 0.85 KMT2A (0.49) CA12CA1CA2CA7CA9
SCHEMBL18360184 0.85 KMT2A (0.49) CA12CA1CA2CA7CA9
SCHEMBL339283 0.85 ALDH1A1 (0.49) MAPTALDH1A1KMT2AKDM4EMEN1
SCHEMBL339506 0.84 PARP10 (0.50) MAPTALDH1A1MAPK1KMT2AHTT
SCHEMBL18360185 0.83 HDAC1 (0.42) MAPTCA1CA2ALDH1A1MAPK1
SCHEMBL26632400 0.82 MAPT (0.43) MAPTCA12CA1CA2CA7

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 MAPT 2838/4885CA12 2792/4885CA1 3352/4885
US-20100041844-A1 RECYCLABLE RUTHENIUM CATALYSTS FOR METATHESIS REACTIONS RPIA, REV1, RCSD1 MAPT 2838/4885CA12 2792/4885CA1 3352/4885
US-20070043180-A1 Recyclable ruthenium catalysts for metathesis reactions RPIA, REV1, RCSD1 MAPT 2838/4885CA12 2792/4885CA1 3352/4885

“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.