SCHEMBL6502022

SCHEMBL6502022

CC1(C)C(=O)N(CC=O)c2ccc(S(C)(=O)=O)cc21

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAPT P10636 3/20 0.39
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
POLB P06746 3/20 0.38
TP53 P04637 2/20 0.38
LMNA P02545 1/20 0.37
THRB P10828 1/20 0.37

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
SCHEMBL6491118 0.88 POLB (0.44) MEN1KMT2AMAPTGAAPKM
SCHEMBL7832671 0.81 MEN1 (0.44) MEN1KMT2AMAPTGAAPKM
SCHEMBL6978569 0.81 MEN1 (0.46) MEN1KMT2AMAPTGAAPKM
SCHEMBL16315801 0.73 PTGDR2 (0.46) MEN1KMT2AMAPTGAAPKM
SCHEMBL13233774 0.72 PTGDR2 (0.45) MEN1KMT2AGAAPKM
SCHEMBL9737582 0.67 MEN1 (0.46) MEN1KMT2AMAPTGAAPKM
SCHEMBL12659259 0.67 ALDH1A1 (0.46) MEN1KMT2AMAPTGAAPOLB
SCHEMBL12659307 0.67 POLB (0.50) MAPTGAAPOLBLMNA
SCHEMBL14609074 0.67 POLB (0.44) MEN1KMT2AMAPTGAAPOLB
SCHEMBL10699847 0.64 AURKA (0.39) MEN1KMT2AMAPTGAAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6844338-B2 Piperidyindoles as serotonin receptor ligands ELI LILLY AND COMPANY (US) 2005-01-18 US disclosed
US-20030225068-A1 Piperidyindoles as serotonin receptor ligands ELI LILLY AND COMPANY 2003-12-04 US disclosed
EP-1286992-A1 PIPERIDYINDOLES AS SEROTONIN RECEPTOR LIGANDS ELI LILLY AND COMPANY (US) 2003-03-05 EP disclosed
WO-2001087881-A1 PIPERIDYINDOLES AS SEROTONIN RECEPTOR LIGANDS ELI LILLY AND COMPANY (US) 2001-11-22 WO 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-20030225068-A1 Piperidyindoles as serotonin receptor ligands CNR1, HTR1D, HTR1A MEN1 4540/4885KMT2A 4688/4885MAPT 4284/4885

“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.