SCHEMBL13640787

SCHEMBL13640787

CCOC(=O)NC1CCCCC(N2CCC3(CC2)COc2ccc(Cl)cc23)C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SETD2 Q9BYW2 2/20 0.37
FAAH O00519 3/20 0.36
AVPR1A P37288 1/20 0.36
ALPG P10696 1/20 0.36
MAPT P10636 2/20 0.36
GAA P10253 1/20 0.36
ALOX15 P16050 1/20 0.36
RECQL P46063 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
LMNA P02545 2/20 0.35
CHRM1 P11229 1/20 0.35
IDO1 P14902 2/20 0.35
TDO2 P48775 2/20 0.35
CYP2C9 P11712 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
SCHEMBL13640795 0.90 CHRNA7 (0.39) POLBALDH1A1MEN1KMT2ASETD2
SCHEMBL13640994 0.83 CHRNA7 (0.38) SETD2
SCHEMBL13641006 0.83 POLB (0.44) POLBSETD2FAAHAVPR1AMAPT
SCHEMBL13640793 0.82 CHRNA7 (0.37) SETD2
SCHEMBL13641040 0.81 NOTUM (0.53) POLBALDH1A1MEN1KMT2ASETD2
SCHEMBL12084193 0.81 CHRM1 (0.43) POLBALDH1A1MEN1KMT2AAVPR1A
SCHEMBL13640938 0.81 CHRNA7 (0.37) SETD2KCNH2
SCHEMBL13641035 0.81 CHRNA7 (0.37) SETD2KCNH2
SCHEMBL13640757 0.81 CHRNA7 (0.39) SETD2
SCHEMBL13640837 0.80 CHRNA7 (0.39) SETD2KCNH2

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-8497295-B2 Spiroindoline modulators of muscarinic receptors VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-07-30 US disclosed
US-20120283243-A1 Spiroindoline Modulators of Muscarinic Receptors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-11-08 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-20120283243-A1 Spiroindoline Modulators of Muscarinic Receptors CHRM3, CHRM2, CHRM5 POLB 4708/4885ALDH1A1 1353/4885MEN1 2451/4885

“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.