SCHEMBL25541125

SCHEMBL25541125

CCOC(=O)C1(F)CCC(C)(OCC)CC1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.34
HIF1A Q16665 1/20 0.34
POLB P06746 1/20 0.33
OPRM1 P35372 8/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 3/20 0.32
TRPA1 O75762 1/20 0.32
OPRD1 P41143 4/20 0.32
OPRK1 P41145 4/20 0.32
SLC22A1 O15245 1/20 0.32
SLC6A4 P31645 1/20 0.32
ADRA1A P35348 1/20 0.32
KCNH2 Q12809 1/20 0.32
ATM Q13315 1/20 0.32
LMNA P02545 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL23883448 0.85 POLB (0.35) POLBOPRM1SMN1; SMN2ALDH1A1TRPA1
SCHEMBL31277004 0.81 ALDH1A1 (0.37) POLBOPRM1SMN1; SMN2ALDH1A1TRPA1
SCHEMBL16058884 0.81 SMN1; SMN2 (0.39) POLBOPRM1SMN1; SMN2ALDH1A1TRPA1
SCHEMBL10477634 0.79 SMN1; SMN2 (0.40) POLBOPRM1SMN1; SMN2ALDH1A1TRPA1
SCHEMBL3181237 0.79 SMN1; SMN2 (0.44) MAPTPOLBOPRM1SMN1; SMN2ALDH1A1
SCHEMBL10477609 0.77 SMN1; SMN2 (0.39) POLBOPRM1SMN1; SMN2ALDH1A1TRPA1
SCHEMBL407780 0.74 OPRM1 (0.51) MAPTPOLBOPRM1SMN1; SMN2ALDH1A1
SCHEMBL9904879 0.74 ALDH1A1 (0.41) MAPTPOLBOPRM1SMN1; SMN2ALDH1A1
SCHEMBL8373078 0.73
Hydrochloric Acid SCHEMBL440141 0.73 OPRM1 (0.50) MAPTPOLBOPRM1SMN1; SMN2ALDH1A1

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-20230157999-A1 PYRANO[4,3-B]INDOLE DERIVATIVES AS ALPHA-1-ANTITRYPSIN MODULATORS FOR TREATING ALPHA-1-ANTITRYPSIN DEFICIENCY (AATD) VERTEX PHARMACEUTICALS (SAN DIEGO) LLC 2023-05-25 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-20230157999-A1 PYRANO[4,3-B]INDOLE DERIVATIVES AS ALPHA-1-ANTITRYPSIN MODULATORS FOR TREATING ALPHA-1-ANTITRYPSIN DEFICIENCY (AATD) SERPINA2, SERPINB1, SERPINE1 MAPT 1326/4885HIF1A 1616/4885POLB 840/4885

“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.