SCHEMBL20109229

SCHEMBL20109229

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

nearest known ligand 0.35

Predicted protein targets (top 15)

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
KMT2A Q03164 1/20 0.31
POLB P06746 2/20 0.30
HTT P42858 1/20 0.30
ALDH1A1 P00352 2/20 0.30
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL20109260 0.83 DRD2 (0.33) DRD2SIGMAR1CHRNA7DPP7KMT2A
SCHEMBL20109155 0.83 DRD2 (0.33) DRD2SIGMAR1CHRNA7DPP7KMT2A
SCHEMBL20109216 0.74 MAPT (0.37) DRD2SIGMAR1CHRNA7KMT2APOLB
SCHEMBL20109214 0.74 CHRNA7 (0.36) DRD2SIGMAR1CHRNA7MAPTMAPK1
SCHEMBL20109209 0.71 CHRNA7 (0.33) DRD2SIGMAR1CHRNA7KMT2AHTT
SCHEMBL20109210 0.71 CHRNA7 (0.33) DRD2SIGMAR1CHRNA7KMT2AHTT
SCHEMBL21866417 0.70 CASP3 (0.37) KMT2AHTTALDH1A1MAPTHPGD
SCHEMBL20109352 0.70 ALDH1A1 (0.36) HTTALDH1A1NPC1MAPTMAPK1
SCHEMBL20113464 0.69 ALDH1A1 (0.35) HTTALDH1A1NPC1MAPTRAB9A
SCHEMBL20109224 0.69 CHRNA7 (0.32) DRD2SIGMAR1CHRNA7NPC1MAPT

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.