SCHEMBL27232172

SCHEMBL27232172

O=C(OC1C[C@H]2COC[C@@H](C1)N2C(=O)O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.65
PTPN2 P17706 3/20 0.57
PTPN1 P18031 3/20 0.57
SMN1; SMN2 Q16637 1/20 0.53
MAPT P10636 2/20 0.49
CYP2C19 P33261 2/20 0.49
CYP2C9 P11712 1/20 0.49
ALDH1A1 P00352 2/20 0.47
HTR3E A5X5Y0 1/20 0.45
HTR3B O95264 1/20 0.45
CHRNA7 P36544 1/20 0.45
HTR3A P46098 1/20 0.45
HTR3D Q70Z44 1/20 0.45
HTR3C Q8WXA8 1/20 0.45
CHRM2 P08172 1/20 0.43
CHRM4 P08173 1/20 0.43
CHRM1 P11229 1/20 0.43
CHRM3 P20309 1/20 0.43
LMNA P02545 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL27228999 1.00 POLB (0.65) POLBPTPN2PTPN1SMN1; SMN2MAPT
SCHEMBL2770045 0.89 POLB (0.77) POLBPTPN2PTPN1SMN1; SMN2MAPT
SCHEMBL23086436 0.89 POLB (0.77) POLBPTPN2PTPN1SMN1; SMN2MAPT
SCHEMBL23086434 0.89 POLB (0.77) POLBPTPN2PTPN1SMN1; SMN2MAPT
SCHEMBL23086437 0.89 POLB (0.77) POLBPTPN2PTPN1SMN1; SMN2MAPT
SCHEMBL29770758 0.85 POLB (0.60) POLBPTPN2PTPN1SMN1; SMN2MAPT
SCHEMBL29582017 0.83 PTPN2 (0.68) POLBPTPN2PTPN1SMN1; SMN2MAPT
SCHEMBL16249777 0.83 POLB (0.53) POLBPTPN2PTPN1SMN1; SMN2MAPT
SCHEMBL22776160 0.82 POLB (0.57) POLBPTPN2PTPN1SMN1; SMN2MAPT
SCHEMBL12275828 0.79 PTPN2 (0.61) POLBPTPN2PTPN1SMN1; SMN2MAPT

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-20240174662-A1 SMALL MOLECULE INHIBITORS OF SALT INDUCIBLE KINASES CILAG AG (CH) 2024-05-30 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-20240174662-A1 SMALL MOLECULE INHIBITORS OF SALT INDUCIBLE KINASES SIK2, SIK1, SGK2 POLB 2630/4885PTPN2 1066/4885PTPN1 1400/4885

“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.