SCHEMBL7795542

SCHEMBL7795542

COC(=O)[C@H]1C[C@H](NC(=O)CCC(C)C)CCN1S(=O)(=O)c1cccs1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.42
NPC1 O15118 1/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
EPHX2 P34913 2/20 0.41
UBE2N P61088 1/20 0.41
ELOVL6 Q9H5J4 1/20 0.40
GAA P10253 1/20 0.40
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL7802259 0.91 SMN1; SMN2 (0.45) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL7804372 0.89 KMT2A (0.44) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL7795549 0.79 MMP2 (0.51)
SCHEMBL7795511 0.72 CA12 (0.57)
SCHEMBL7805690 0.71 MMP2 (0.63)
SCHEMBL7427121 0.70 MEN1 (0.55) RAB9AKMT2AMEN1SMN1; SMN2EPHX2
SCHEMBL7226664 0.67 POLB (0.62) RAB9ANPC1KMT2AMEN1UBE2N
SCHEMBL25272718 0.64 MMP2 (0.47) KMT2AUBE2NALDH1A1
SCHEMBL7795572 0.64 MMP1 (0.61) KMT2AMEN1ALDH1A1
SCHEMBL7805592 0.64 MMP1 (0.50) KMT2AALDH1A1

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 RAB9A 149/4885NPC1 631/4885KMT2A 3353/4885

“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.