SCHEMBL10167274

SCHEMBL10167274

CC(C)(C)c1cc2c(c(C(C)(C)C)c1)OC(=O)C2c1cccc(C(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.41
GABBR1 Q9UBS5 1/20 0.41
HTR2C P28335 3/20 0.37
HTR2A P28223 1/20 0.37
HTR2B P41595 1/20 0.37
MPO P05164 1/20 0.36
KDM1A O60341 1/20 0.35
RCOR1 Q9UKL0 1/20 0.35
CYP2C19 P33261 1/20 0.34
LMNA P02545 1/20 0.34
HTR1A P08908 1/20 0.33
PBRM1 Q86U86 1/20 0.33
GUSB P08236 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
SCHEMBL10167275 0.88 GABBR2 (0.44) GABBR2GABBR1
SCHEMBL1232078 0.86 GABBR2 (0.43) GABBR2GABBR1HTR2C
SCHEMBL10135353 0.85 GAA (0.42) GABBR2GABBR1HTR2CHTR2AHTR2B
SCHEMBL466160 0.85 GAA (0.46) GABBR2GABBR1HTR2BCYP2C19LMNA
SCHEMBL31247883 0.85 GAA (0.46) GABBR2GABBR1HTR2BCYP2C19LMNA
SCHEMBL21840813 0.84 GABBR2 (0.39) GABBR2GABBR1HTR2CHTR2AHTR2B
SCHEMBL10135354 0.83 GABBR2 (0.41) GABBR2GABBR1
SCHEMBL5083413 0.83 GABBR2 (0.43) GABBR2GABBR1
SCHEMBL7676603 0.82 GABBR2 (0.35) GABBR2GABBR1
SCHEMBL12901560 0.81 GRM2 (0.39) GABBR2GABBR1

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
EP-2464739-B1 METHODS IN CELL CULTURES, AND RELATED INVENTIONS, EMPLOYING CERTAIN ADDITIVES BASF SE (DE) 2016-01-13 EP disclosed
US-8859235-B2 Methods in cell cultures, and related inventions, employing certain additives BASF SE (DE) 2014-10-14 US disclosed
US-20120164162-A1 METHODS IN CELL CULTURES, AND RELATED INVENTIONS, EMPLOYING CERTAIN ADDITIVES BASF SE (DE) 2012-06-28 US disclosed
WO-2011018472-A2 METHODS IN CELL CULTURES, AND RELATED INVENTIONS, EMPLOYING CERTAIN ADDITIVES BASF SE (DE) 2011-02-17 WO 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-20120164162-A1 METHODS IN CELL CULTURES, AND RELATED INVENTIONS, EMPLOYING CERTAIN ADDITIVES BBOX1, NEFM, NQO1 GABBR2 497/4885GABBR1 256/4885HTR2C 1360/4885

“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.