SCHEMBL13929265

SCHEMBL13929265

C[C@H](CN(c1cccc(F)c1)S(=O)(=O)CC1CCCCC1)N1CCC(NC(=O)Cc2ccc(C(=N)N)cc2)CC1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ SIGMAR1 Q99720 5/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ F2 P00734 3/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC6 Q9UBN7 1/20 0.37
▸ F10 P00742 4/20 0.36
▸ TMPRSS6 Q8IU80 3/20 0.36
▸ CCR3 P51677 1/20 0.35
▸ ST14 Q9Y5Y6 2/20 0.35
▸ OPRM1 P35372 1/20 0.35
▸ ALDH1A1 P00352 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
SCHEMBL13929244 0.92 PKM (0.46) PKMTSHRSIGMAR1MEN1KMT2A
SCHEMBL13951540 0.88 OGA (0.43) PKMTSHRSIGMAR1MEN1KMT2A
SCHEMBL13929262 0.85 SIGMAR1 (0.48) PKMTSHRSIGMAR1MEN1KMT2A
SCHEMBL13929260 0.82 PKM (0.46) PKMTSHRSIGMAR1F2F10
SCHEMBL13929259 0.81 RORC (0.44) SIGMAR1MEN1KMT2AF2F10
SCHEMBL13929264 0.81 SIGMAR1 (0.47) PKMTSHRSIGMAR1F2F10
SCHEMBL13929263 0.80 PKM (0.54) PKMTSHRSIGMAR1CCR3OPRM1
SCHEMBL13929239 0.78 PKM (0.52) PKMTSHRSIGMAR1CCR3
SCHEMBL13929291 0.77 SIGMAR1 (0.46) PKMTSHRSIGMAR1CCR3OPRM1
SCHEMBL13929242 0.77 SIGMAR1 (0.51) PKMTSHRSIGMAR1CCR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090054451-A1 Use of Piperidine Derivatives as Agonists of Chemokine Receptor Activity EUROSCREEN S.A. (BE) 2009-02-26 — — US disclosed
US-20090054451-A1 Use of Piperidine Derivatives as Agonists of Chemokine Receptor Activity EUROSCREEN S.A. (BE) 2009-02-26 — — 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-20090054451-A1 Use of Piperidine Derivatives as Agonists of Chemokine Receptor Activity ACKR3, CCR5, CCR7 PKM 3209/4885TSHR 636/4885SIGMAR1 129/4885

“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.

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