SCHEMBL5229994

SCHEMBL5229994

Cc1cc(N2CCCN(C(=O)OC(C)(C)C)CC2)ccc1F

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.53
MAPT P10636 3/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
GPR119 Q8TDV5 5/20 0.49
SMN1; SMN2 Q16637 3/20 0.47
CYP2C19 P33261 1/20 0.47
SUV39H2 Q9H5I1 1/20 0.47
CKS1B P61024 1/20 0.46
SKP1 P63208 1/20 0.46
SKP2 Q13309 1/20 0.46
HTT P42858 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
TSHR P16473 1/20 0.46
NAMPT P43490 1/20 0.46
ALK Q9UM73 1/20 0.45

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
SCHEMBL5231336 0.91 PDK2 (0.53) PDK2MAPTALDH1A1LMNAMEN1
SCHEMBL30567184 0.90 PDK2 (0.55) PDK2MAPTALDH1A1LMNAMEN1
SCHEMBL5234283 0.90 PDK2 (0.55) PDK2MAPTALDH1A1LMNAMEN1
SCHEMBL5235793 0.89 MAPT (0.55) PDK2MAPTALDH1A1LMNAMEN1
SCHEMBL5239016 0.87 MEN1 (0.55) PDK2MAPTALDH1A1LMNAMEN1
SCHEMBL22652114 0.86 MAPT (0.55) PDK2MAPTALDH1A1LMNAMEN1
SCHEMBL24124829 0.85 MAPT (0.56) PDK2MAPTALDH1A1LMNAMEN1
SCHEMBL20159003 0.85 MAPT (0.59) PDK2MAPTALDH1A1LMNAMEN1
SCHEMBL31111852 0.85 PDK2 (0.53) PDK2MAPTALDH1A1LMNAMEN1
SCHEMBL21533464 0.84 MEN1 (0.65) PDK2MAPTALDH1A1LMNAMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070219234-A1 Thienopyridine Derivatives SANKYO COMPANY, LIMITED (JP) 2007-09-20 US disclosed
EP-1764367-A1 THIENOPYRIDINE DERIVATIVES Sankyo Company, Limited (JP) 2007-03-21 EP 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-20070219234-A1 Thienopyridine Derivatives RASGRP1, NRAS, HRH3 PDK2 3467/4885MAPT 4452/4885ALDH1A1 1073/4885

“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.