SCHEMBL4757640

SCHEMBL4757640

CS(=O)(=O)CC(=O)N1CCCC(C=O)C1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
JAK3 P52333 1/20 0.35
HCRTR2 O43614 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 1/20 0.33
ATM Q13315 1/20 0.33
HSD17B10 Q99714 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
KDM1A O60341 2/20 0.32

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
SCHEMBL27240732 0.81 NPC1 (0.38) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL12385779 0.80 ALDH1A1 (0.63) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL4757549 0.79 ALDH1A1 (0.41) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL18733292 0.78 NAMPT (0.41) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL14009858 0.77 ALDH1A1 (0.43) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL12384428 0.76 ALDH1A1 (0.40) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL4756935 0.76 ALDH1A1 (0.40) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL2639873 0.75 ALDH1A1 (0.38) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL2421426 0.73 HPGD (0.33) ALDH1A1LMNAKMT2AMEN1POLB
SCHEMBL16528331 0.73 HPGD (0.33) ALDH1A1LMNAKMT2AMEN1POLB

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
US-20080275085-A1 Piperidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 US claimed
WO-2008133344-A2 PIPERIDINE DERIVATIVE AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 WO disclosed
US-20080275085-A1 Piperidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-06 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-20080275085-A1 Piperidine derivative and use thereof TACR2, TACR1, PRLHR ALDH1A1 3412/4885LMNA 4742/4885KMT2A 288/4885

“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.