SCHEMBL7802259

SCHEMBL7802259

CC(C)CCC(=O)N[C@@H]1CCN(S(=O)(=O)c2cccs2)[C@@H](C(=O)O)C1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.45
KMT2A Q03164 2/20 0.44
RAB9A P51151 2/20 0.44
NPC1 O15118 1/20 0.44
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
ALDH1A1 P00352 2/20 0.42
UBE2N P61088 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
EPHX2 P34913 1/20 0.42
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL7804372 0.91 KMT2A (0.44) SMN1; SMN2KMT2ARAB9ANPC1MEN1
SCHEMBL7795542 0.91 RAB9A (0.42) SMN1; SMN2KMT2ARAB9ANPC1MEN1
SCHEMBL7795511 0.77 CA12 (0.57)
SCHEMBL7226664 0.75 POLB (0.62) KMT2ARAB9ANPC1MEN1POLB
SCHEMBL7226660 0.75 POLB (0.62) KMT2ARAB9ANPC1MEN1POLB
SCHEMBL3719656 0.72 POLB (0.61) RAB9APOLBALDH1A1UBE2NTDP1
SCHEMBL7427121 0.72 MEN1 (0.55) SMN1; SMN2KMT2ARAB9AMEN1POLB
SCHEMBL12995467 0.71 POLB (0.53) SMN1; SMN2KMT2ARAB9AMEN1POLB
SCHEMBL2881064 0.71 ALDH1A1 (0.62) RAB9ANPC1POLBALDH1A1UBE2N
SCHEMBL7795549 0.70 MMP2 (0.51)

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-20010056184-A1 Pipecolinic acid derivatives, method of manufacturing the same and therapeutic agents containing these compounds KOTOBUKI PHARMACEUTICAL CO., LTD. (JP) 2001-12-27 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-20010056184-A1 Pipecolinic acid derivatives, method of manufacturing the same and therapeutic agents containing these compounds NCEH1, NOP10, HRH1 SMN1; SMN2 2467/4885KMT2A 3353/4885RAB9A 149/4885

“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.