SCHEMBL12124403

SCHEMBL12124403

COOCCNC(=O)c1ccc(C)cc1F

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.45
HTT P42858 1/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 2/20 0.44
ESRRG P62508 1/20 0.43
PDE10A Q9Y233 1/20 0.43
LOXL2 Q9Y4K0 1/20 0.43
DRD2 P14416 1/20 0.41
DRD3 P35462 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
POLB P06746 2/20 0.41
HPGD P15428 1/20 0.41

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
SCHEMBL12124297 0.90 MEN1 (0.56) KMT2AMEN1SMN1; SMN2HTTLOXL2
SCHEMBL12121132 0.81 POLB (0.53) KMT2AMEN1SMN1; SMN2HTTNPC1
SCHEMBL14243219 0.81 SMN1; SMN2 (0.50) KMT2AMEN1SMN1; SMN2HTTNPC1
SCHEMBL12121122 0.78 HTT (0.57) KMT2AMEN1SMN1; SMN2HTTNPC1
SCHEMBL12121118 0.78 LOXL2 (0.51) KMT2AMEN1SMN1; SMN2HTTNPC1
SCHEMBL15095650 0.78 EGLN1 (0.46) KMT2AMEN1SMN1; SMN2HTTNPC1
SCHEMBL12121033 0.77 LOXL2 (0.49) KMT2AMEN1SMN1; SMN2HTTNPC1
SCHEMBL24386505 0.77 SMN1; SMN2 (0.47) KMT2AMEN1SMN1; SMN2HTTNPC1
SCHEMBL3867188 0.77 SMN1; SMN2 (0.47) KMT2AMEN1SMN1; SMN2HTTNPC1
SCHEMBL12121026 0.77 HTT (0.74) KMT2AMEN1SMN1; SMN2HTTLOXL2

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-20110281865-A1 NOVEL 3,5-DISUBSTITUTED-3H-IMIDAZO[4,5-B]PYRIDINE AND 3,5- DISUBSTITUTED -3H-[1,2,3]TRIAZOLO[4,5-B] PYRIDINE COMPOUNDS AS MODULATORS OF PROTEIN KINASES RHIZEN PHARMACEUTICALS SA (CH) 2011-11-17 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-20110281865-A1 NOVEL 3,5-DISUBSTITUTED-3H-IMIDAZO[4,5-B]PYRIDINE AND 3,5- DISUBSTITUTED -3H-[1,2,3]TRIAZOLO[4,5-B] PYRIDINE COMPOUNDS AS MODULATORS OF PROTEIN KINASES MAP4K2, MAP4K3, MAP3K1 KMT2A 2734/4885MEN1 4376/4885SMN1; SMN2 2665/4885

“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.