SCHEMBL20109260

SCHEMBL20109260

CCC(=C1CCCCC1)P1(=N)N(c2ccccc2)CCN1c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
CHRNA7 P36544 2/20 0.32
DPP7 Q9UHL4 2/20 0.31
POLB P06746 1/20 0.30
HTT P42858 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL20109155 0.83 DRD2 (0.33) DRD2SIGMAR1CHRNA7DPP7POLB
SCHEMBL20109229 0.83 DRD2 (0.33) DRD2SIGMAR1CHRNA7DPP7POLB
SCHEMBL20113464 0.81 ALDH1A1 (0.35) HTT
SCHEMBL20109240 0.74 CHRNA7 (0.36) DRD2SIGMAR1CHRNA7
SCHEMBL20109237 0.74 MAPT (0.37) DRD2SIGMAR1CHRNA7
SCHEMBL20109236 0.71 CHRNA7 (0.33) DRD2SIGMAR1CHRNA7
SCHEMBL20109233 0.71 CHRNA7 (0.33) DRD2SIGMAR1CHRNA7
SCHEMBL21866417 0.70 CASP3 (0.37) HTTMEN1KMT2A
SCHEMBL20109352 0.70 ALDH1A1 (0.36) HTT
SCHEMBL20109235 0.70 SMN1; SMN2 (0.40) CHRNA7MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180118770-A1 N-Heterocyclic Phosphines THE BOARD OF REGENTS OF THE NEVADA SYSTEM OF HIGHER EDUCATION ON BEHALF OF THE UNIVERSITY OF NEVADA, LAS VEGAS 2018-05-03 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-20180118770-A1 N-Heterocyclic Phosphines NANP, PPIP5K2, PHPT1 DRD2 2561/4885SIGMAR1 2527/4885CHRNA7 3780/4885

“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.