SCHEMBL909291

SCHEMBL909291

CCC(C(=O)O)c1ccccc1OC(F)F

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.44
MEN1 O00255 2/20 0.44
RAB9A P51151 1/20 0.44
TSHR P16473 1/20 0.41
LMNA P02545 2/20 0.41
HPGD P15428 2/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 1/20 0.40
GLA P06280 1/20 0.39
KCNK3 O14649 1/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
CASP1 P29466 1/20 0.39
HTT P42858 1/20 0.38

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
SCHEMBL1999919 0.83 POLB (0.53) KMT2AMEN1TSHRLMNASMN1; SMN2
SCHEMBL29889833 0.83 POLB (0.53) KMT2AMEN1TSHRLMNASMN1; SMN2
SCHEMBL28222557 0.82 L3MBTL1 (0.54) KMT2AMEN1HPGDL3MBTL1ALDH1A1
SCHEMBL18304343 0.79 PTGS2 (0.47) KMT2AMEN1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL28209569 0.77 MRGPRX4 (0.49) LMNAL3MBTL1ALDH1A1
SCHEMBL1822253 0.77 ALDH1A1 (0.39) KMT2AMEN1LMNAL3MBTL1ALDH1A1
SCHEMBL1876225 0.77 L3MBTL1 (0.41) KMT2ALMNASMN1; SMN2L3MBTL1ALDH1A1
SCHEMBL11392218 0.76 ALDH1A1 (0.37) KMT2AMEN1LMNAHPGDSMN1; SMN2
SCHEMBL9537251 0.76 KMT2A (0.42) KMT2AMEN1RAB9ATSHRHPGD
SCHEMBL28831706 0.76 L3MBTL1 (0.43) KMT2AMEN1RAB9ALMNASMN1; SMN2

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-7935815-B2 Imidazoyl pyridine compounds and salts thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-05-03 US disclosed
US-20110009619-A1 POLYCYCLIC COMPOUND EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-01-13 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-20110009619-A1 POLYCYCLIC COMPOUND APP, BACE1, PSEN1 KMT2A 1666/4885MEN1 424/4885RAB9A 2861/4885

“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.