SCHEMBL13640795

SCHEMBL13640795

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.39
SETD2 Q9BYW2 4/20 0.38
MEN1 O00255 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
NSD2 O96028 1/20 0.36
CYP2C8 P10632 1/20 0.36
DRD2 P14416 1/20 0.36
HTR1B P28222 1/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 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
ACKR3 P25106 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
SCHEMBL13640994 0.93 CHRNA7 (0.38) CHRNA7SETD2NSD2CYP2C8DRD2
SCHEMBL13640793 0.92 CHRNA7 (0.37) CHRNA7SETD2NSD2CYP2C8DRD2
SCHEMBL13640837 0.91 CHRNA7 (0.39) CHRNA7SETD2NSD2CYP2C8DRD2
SCHEMBL13641035 0.91 CHRNA7 (0.37) CHRNA7SETD2NSD2CYP2C8DRD2
SCHEMBL13640938 0.91 CHRNA7 (0.37) CHRNA7SETD2NSD2CYP2C8DRD2
SCHEMBL13640757 0.91 CHRNA7 (0.39) CHRNA7SETD2NSD2CYP2C8DRD2
SCHEMBL13640876 0.90 CHRNA7 (0.39) CHRNA7SETD2NSD2CYP2C8DRD2
SCHEMBL13640844 0.90 CHRNA7 (0.38) CHRNA7SETD2NSD2CYP2C8DRD2
SCHEMBL13640787 0.90 POLB (0.42) SETD2MEN1KMT2AMAPTALDH1A1
SCHEMBL13640995 0.89 CHRNA7 (0.41) CHRNA7SETD2NSD2CYP2C8DRD2

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 CHRNA7 23/4885SETD2 3573/4885MEN1 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.