SCHEMBL3098100

SCHEMBL3098100

CCC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.62
PKM P14618 1/20 0.62
EPHX1 P07099 1/20 0.48
TGFBR1 P36897 6/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HPGD P15428 1/20 0.47
GPR119 Q8TDV5 1/20 0.46
FPR3 P25089 1/20 0.46
FPR2 P25090 1/20 0.46
GLS O94925 1/20 0.46
RECQL P46063 1/20 0.45

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
SCHEMBL31117959 0.87 KDM4E (0.60) KDM4EPKMEPHX1TGFBR1SMN1; SMN2
SCHEMBL3050761 0.87 KDM4E (0.60) KDM4EPKMEPHX1TGFBR1SMN1; SMN2
SCHEMBL21551436 0.87 KDM4E (0.63) KDM4EPKMEPHX1SMN1; SMN2HPGD
SCHEMBL6402066 0.86 KDM4E (0.59) KDM4EPKMEPHX1TGFBR1SMN1; SMN2
SCHEMBL18980843 0.85 KDM4E (0.56) KDM4EPKMEPHX1TGFBR1SMN1; SMN2
SCHEMBL24853346 0.85 KDM4E (0.64) KDM4EPKMEPHX1TGFBR1SMN1; SMN2
SCHEMBL1245476 0.85 KDM4E (0.64) KDM4EPKMEPHX1TGFBR1SMN1; SMN2
SCHEMBL6152939 0.85 KDM4E (0.68) KDM4EPKMEPHX1TGFBR1SMN1; SMN2
SCHEMBL6150181 0.85 KDM4E (0.58) KDM4EPKMEPHX1TGFBR1HPGD
SCHEMBL5573225 0.85 KDM4E (0.63) KDM4EPKMEPHX1TGFBR1SMN1; SMN2

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-11739174-B2 Cationic cyclic amine and amphipathic transfection reagents MIRUS BIO LLC (US) 2023-08-29 US disclosed
US-20100234427-A1 1-PHENETHYLPIPERIDINE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS NEUROSEARCH A/S (DK) 2010-09-16 US disclosed
EP-1987001-B1 1-PHENETHYLPIPERIDINE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS NEUROSEARCH AS (DK) 2010-05-05 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 (2 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-20100234427-A1 1-PHENETHYLPIPERIDINE DERIVATIVES AND THEIR USE AS OPIOID RECEPTOR LIGANDS OPRL1, OPRM1, OPRK1 KDM4E 622/4885PKM 1707/4885EPHX1 619/4885
US-11739174-B2 Cationic cyclic amine and amphipathic transfection reagents SLC7A1, PARN, PARG KDM4E 4494/4885PKM 2772/4885EPHX1 4508/4885

“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.