SCHEMBL6311485

SCHEMBL6311485

CCCCC(C(=O)OCC)C(=O)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 5/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CA2 P00918 2/20 0.40
CA1 P00915 1/20 0.40
L3MBTL1 Q9Y468 4/20 0.39
MAPK1 P28482 4/20 0.39
TSHR P16473 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPT P10636 2/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
CYP3A4 P08684 1/20 0.36
ATM Q13315 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL455720 0.86 TDP1 (0.53) TDP1MEN1KMT2ACA2CA1
Ammonia Solution, Strong SCHEMBL27849182 0.84 TDP1 (0.51) TDP1MEN1KMT2ACA2CA1
SCHEMBL11832901 0.84 TDP1 (0.51) TDP1MEN1KMT2ACA2CA1
SCHEMBL8462480 0.83 CA2 (0.43) CA2CA1MAPK1POLB
SCHEMBL1292730 0.82 TDP1 (0.50) TDP1MEN1KMT2ACA2CA1
SCHEMBL27816951 0.81 TDP1 (0.38) TDP1MEN1KMT2AL3MBTL1MAPK1
SCHEMBL650590 0.80 TDP1 (0.45) TDP1MEN1KMT2ACA2CA1
SCHEMBL4416132 0.79 TDP1 (0.51) TDP1MEN1KMT2ACA1L3MBTL1
SCHEMBL10137807 0.79 CA2 (0.50) TDP1CA2CA1MAPK1MAPT
SCHEMBL245120 0.79 CA1 (0.46) CA2CA1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1633434-A Imidazo [1, 2-a ] pyridine derivatives DAIICHI SEIYAKU CO (JP) 2005-06-29 CN disclosed
US-20050113397-A1 Imidazo[1,2-a]pyridine derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-05-26 US disclosed
EP-1479681-A1 IMIDAZO(1,2-a)PYRIDINE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-11-24 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-20050113397-A1 Imidazo[1,2-a]pyridine derivative MANBA, MAN2B1, ERG28 TDP1 2394/4885MEN1 2268/4885KMT2A 4210/4885

“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.