SCHEMBL13930709

SCHEMBL13930709

C[C@H](CN(c1cccc(F)c1)S(=O)(=O)CC1CCCCC1)N1CCC(CC(=O)Nc2ccc(F)cc2F)CC1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.42
▸ RORC P51449 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ TP53 P04637 1/20 0.39
▸ OPRM1 P35372 1/20 0.38
▸ RAB9A P51151 1/20 0.37
▸ TSHR P16473 1/20 0.37
▸ AAK1 Q2M2I8 1/20 0.37
▸ EPHX2 P34913 1/20 0.37
▸ NPY2R P49146 1/20 0.36

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
SCHEMBL13930773 0.85 OPRM1 (0.38) MAPTRORCALDH1A1OPRM1
SCHEMBL13930708 0.84 MAPT (0.38) MAPTRORCSMN1; SMN2ALDH1A1LMNA
SCHEMBL13930847 0.84 OPRM1 (0.47) MAPTTP53OPRM1RAB9A
SCHEMBL13930735 0.84 OPRM1 (0.47) MAPTTP53OPRM1RAB9A
SCHEMBL13929244 0.82 PKM (0.46) OPRM1TSHR
SCHEMBL13931073 0.81 LMNA (0.42) SMN1; SMN2ALDH1A1LMNAGAATP53
SCHEMBL13930725 0.80 LMNA (0.40) MAPTLMNARAB9A
SCHEMBL13951540 0.77 OGA (0.43) OPRM1TSHR
SCHEMBL4254638 0.76 RAB9A (0.47) MAPTSMN1; SMN2TP53RAB9ATSHR
SCHEMBL4254635 0.76 RAB9A (0.47) MAPTSMN1; SMN2TP53RAB9ATSHR

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-20090048291-A1 Novel Piperidine-4-Acetic Acid Derivatives and Their Use EUROSCREEN S.A. (BE) 2009-02-19 — — US disclosed
US-20090048291-A1 Novel Piperidine-4-Acetic Acid Derivatives and Their Use EUROSCREEN S.A. (BE) 2009-02-19 — — 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-20090048291-A1 Novel Piperidine-4-Acetic Acid Derivatives and Their Use ALDH1A1, ABAT, ALDH18A1 MAPT 2479/4885RORC 876/4885SMN1; SMN2 2750/4885

“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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