SCHEMBL26817757

SCHEMBL26817757

C[C@H]1CN(CC(F)F)CCO1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDK1 Q15118 1/20 0.44
KDM1A O60341 1/20 0.39
DRD1 P21728 1/20 0.35
GLRA1 P23415 1/20 0.34
GRM2 Q14416 2/20 0.32
KCNH2 Q12809 1/20 0.32
HDAC6 Q9UBN7 2/20 0.32
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
CNR2 P34972 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
SCHEMBL20921432 0.82 PIK3CD (0.42) PDK1KDM1ADRD1GLRA1CNR2
SCHEMBL17828068 0.82 PIK3CD (0.42) PDK1KDM1ADRD1GLRA1CNR2
SCHEMBL18556758 0.82 PIK3CD (0.42) PDK1KDM1ADRD1GLRA1CNR2
SCHEMBL932483 0.79 PDK1 (0.40) PDK1KDM1ADRD1GLRA1CNR2
SCHEMBL9801239 0.79 PDK1 (0.43) PDK1KDM1ADRD1GLRA1
SCHEMBL24737031 0.78 DRD4 (0.36) PDK1
SCHEMBL16445720 0.77 ATM (0.46) PDK1KDM1ADRD1GLRA1
SCHEMBL8227861 0.77 PDK1 (0.38) PDK1KDM1ADRD1GLRA1GRM2
SCHEMBL13415808 0.75
SCHEMBL9801457 0.75

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-11834450-B2 Compounds having ((3-nitrophenyl)sulfonyl)acetamide as BCL-2 inhibitors Eil Therapeutics, Inc. (US) 2023-12-05 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-11834450-B2 Compounds having ((3-nitrophenyl)sulfonyl)acetamide as BCL-2 inhibitors BCL2, BCL2A1, BCL2L1 PDK1 228/4885KDM1A 1630/4885DRD1 4799/4885

“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.