SCHEMBL25237462

SCHEMBL25237462

C[C@H](CNC(=O)CCl)NC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.40
SMN1; SMN2 Q16637 7/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
LMNA P02545 5/20 0.37
ATM Q13315 1/20 0.35
HTT P42858 4/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
MAPT P10636 2/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
NCOA1 Q15788 1/20 0.31
NCOA3 Q9Y6Q9 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
SCHEMBL16094155 1.00 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2CYP2D6CYP2C19LMNA
SCHEMBL5830226 0.88 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2CYP2D6CYP2C19LMNA
SCHEMBL2739998 0.81 CYP2D6 (0.61) ALDH1A1CYP2D6CYP2C19LMNAATM
SCHEMBL28707499 0.81 CYP2D6 (0.61) ALDH1A1CYP2D6CYP2C19LMNAATM
SCHEMBL3486081 0.76
SCHEMBL20818221 0.75 CA2 (0.45) CYP2D6KMT2AMEN1
SCHEMBL20818224 0.75 CA2 (0.45) CYP2D6KMT2AMEN1
SCHEMBL20605829 0.74
SCHEMBL18758356 0.74
SCHEMBL3578313 0.73

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-20230203028-A1 PYRIDAZINONES AND METHODS OF USE THEREOF GFB (ABC), LLC 2023-06-29 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-20230203028-A1 PYRIDAZINONES AND METHODS OF USE THEREOF PDXK, ATP6V1B1, REN ALDH1A1 649/4885SMN1; SMN2 2435/4885CYP2D6 45/4885

“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.