SCHEMBL10273076

SCHEMBL10273076

CCc1cc(-c2ccc(F)cc2)ccc1C1C(=O)[C@@H]2[C@H](C1O)[C@H]1CC[C@@H]2O1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.33
HDAC3 O15379 2/20 0.31
HDAC1 Q13547 2/20 0.31
HDAC2 Q92769 2/20 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
SCHEMBL6727385 0.81 KDM1A (0.36) GRM2HDAC3HDAC1HDAC2
SCHEMBL18874266 0.81 KDM1A (0.36) GRM2HDAC3HDAC1HDAC2
SCHEMBL18874242 0.70 HSD17B1 (0.34) HDAC3HDAC1HDAC2
SCHEMBL6727346 0.70 HSD17B1 (0.34) HDAC3HDAC1HDAC2
SCHEMBL18874001 0.69 TAAR1 (0.41) GRM2HDAC1HDAC2
SCHEMBL6727873 0.69 TAAR1 (0.41) GRM2HDAC1HDAC2
SCHEMBL18874115 0.62 L3MBTL1 (0.36) HDAC3HDAC1HDAC2
SCHEMBL6727919 0.62 L3MBTL1 (0.36) HDAC3HDAC1HDAC2
SCHEMBL18873867 0.61 L3MBTL1 (0.33)
SCHEMBL18874265 0.61 PGR (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120142529-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION, INC. (US) 2012-06-07 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 (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-20120142529-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 GRM2 23/4885HDAC3 946/4885HDAC1 1406/4885

“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.