SCHEMBL12705473

SCHEMBL12705473

CC1(O)C2CC3CC1CC(COCC(F)F)(C3)C2

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
ALDH1A1 P00352 2/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
GBA1 P04062 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
SCN5A Q14524 1/20 0.30
SCN9A Q15858 1/20 0.30
GBA2 Q9HCG7 1/20 0.30

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
SCHEMBL12705479 0.85 LMNA (0.34) LMNAALDH1A1CA12CA1CA2
SCHEMBL12705477 0.85 ALDH1A1 (0.31) ALDH1A1CA12CA1CA2CA9
SCHEMBL12705480 0.82 ALDH1A1 (0.31) ALDH1A1MEN1KMT2AL3MBTL1
SCHEMBL685934 0.78 ALDH1A1 (0.31) ALDH1A1CA12CA1CA2CA9
SCHEMBL12705458 0.73
SCHEMBL686572 0.72 SCN9A (0.33) ALDH1A1SCN5ASCN9A
SCHEMBL12705455 0.72 MEN1 (0.35) MEN1KMT2A
SCHEMBL12705470 0.72 PKM (0.41) LMNAALDH1A1CA12CA1CA2
SCHEMBL17281556 0.72 CA12 (0.38) LMNAALDH1A1CA12CA1CA2
SCHEMBL22176776 0.71 GRIN2D (0.38) ALDH1A1MEN1KMT2AL3MBTL1

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-20110091808-A1 PHOTORESIST COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-04-21 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-20110091808-A1 PHOTORESIST COMPOSITION ASIC1, ASIC3, SUN2 LMNA 3534/4885ALDH1A1 2111/4885CA12 1442/4885

“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.