SCHEMBL11989367

SCHEMBL11989367

COc1cc(C)cc(C)c1C1=C(O)C2(CCC(OC)CC2)OC1=O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.35
RECQL P46063 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TSHR P16473 2/20 0.34
ACACB O00763 1/20 0.34
ACACA Q13085 1/20 0.34
CRHR1 P34998 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
PABPC1 P11940 1/20 0.31
EIF4H Q15056 1/20 0.31

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
SCHEMBL11989359 0.92 ACACB (0.35) MAPTRECQLALDH1A1TSHRACACB
SCHEMBL11989368 0.89 ALDH1A1 (0.40) MAPTRECQLALDH1A1TSHRACACB
SCHEMBL782482 0.84 MAPT (0.33) MAPTRECQLALDH1A1TSHRCRHR1
SCHEMBL812254 0.83 BACE1 (0.34) MAPTTSHRACACBACACA
SCHEMBL27374303 0.81 TSHR (0.33) MAPTTSHR
SCHEMBL13944832 0.80
SCHEMBL30737090 0.78 TSHR (0.36) MAPTTSHR
SCHEMBL27378208 0.78 TSHR (0.31) TSHR
SCHEMBL30737150 0.78 TSHR (0.31) TSHR
SCHEMBL811977 0.78 ACACB (0.44) ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1962599-B1 INSECTICIDE COMPOUNDS WITH IMPROVED EFFECT BAYER IP GMBH (DE) 2016-03-16 EP disclosed
US-8247351-B2 Insecticidal compositions having improved effect BAYER CROPSCIENCE AG (DE) 2012-08-21 US disclosed
US-8247351-B2 Insecticidal compositions having improved effect BAYER CROPSCIENCE AG (DE) 2012-08-21 US disclosed
US-20110294783-A1 Insecticidal Compositions Having Improved Effect BAYER CROPSCIENCE AG (DE) 2011-12-01 US disclosed
US-20110294783-A1 Insecticidal Compositions Having Improved Effect BAYER CROPSCIENCE AG (DE) 2011-12-01 US disclosed
US-20090209513-A1 Insecticidal Compositions Having Improved Effect BAYER CROPSCIENCE AG (DE) 2009-08-20 US disclosed
US-20090209513-A1 Insecticidal Compositions Having Improved Effect BAYER CROPSCIENCE AG (DE) 2009-08-20 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 (2 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-20110294783-A1 Insecticidal Compositions Having Improved Effect FASN, CYP51A1, PIKFYVE MAPT 3493/4885RECQL 3016/4885ALDH1A1 4489/4885
US-20090209513-A1 Insecticidal Compositions Having Improved Effect PTEN, PIK3CG, PIK3CD MAPT 2447/4885RECQL 1804/4885ALDH1A1 4708/4885

“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.