SCHEMBL6470796

SCHEMBL6470796

CCCNC(C)CCc1ccc(N)nc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
OPRK1 P41145 2/20 0.41
SIGMAR1 Q99720 4/20 0.41
ADRB2 P07550 3/20 0.39
LMNA P02545 2/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPK1 P28482 2/20 0.39
ADRB1 P08588 2/20 0.39
CPB2 Q96IY4 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SLC22A1 O15245 1/20 0.39
CA12 O43570 1/20 0.39
EGFR P00533 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
LCK P06239 1/20 0.39
FYN P06241 1/20 0.39
CA3 P07451 1/20 0.39

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
SCHEMBL5132147 0.92 HTT (0.41) HTTSMN1; SMN2OPRK1SIGMAR1ADRB2
SCHEMBL5132972 0.88 HTT (0.43) HTTSMN1; SMN2OPRK1SIGMAR1ADRB2
SCHEMBL5133519 0.88 CPB2 (0.40) HTTSMN1; SMN2OPRK1SIGMAR1ADRB2
SCHEMBL5132093 0.84 ADRB2 (0.41) HTTSMN1; SMN2OPRK1ADRB2ADRB1
SCHEMBL6470834 0.81 CPB2 (0.42) SIGMAR1CPB2SLC6A4GABRPGABRD
SCHEMBL5044960 0.80 CPB2 (0.41) HTTSMN1; SMN2CPB2SLC6A4CYP1A2
SCHEMBL5037248 0.80 MEN1 (0.40) HTTSMN1; SMN2OPRK1ADRB2ADRB1
SCHEMBL5131617 0.80 BCHE (0.58) SMN1; SMN2OPRK1SIGMAR1CPB2MEN1
SCHEMBL6470792 0.80 KDM4E (0.45) HTTSMN1; SMN2OPRK1SIGMAR1ADRB2
SCHEMBL6469030 0.79 KCNH2 (0.56) MEN1KMT2AKCNH2CYP1A2CYP2D6

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-20050107381-A1 6-membered heteroaryl compounds for the treatment of neurodegenerative disorders PFIZER, INC. 2005-05-19 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-20050107381-A1 6-membered heteroaryl compounds for the treatment of neurodegenerative disorders APP, BACE1, SNCA HTT 6/4885SMN1; SMN2 106/4885OPRK1 1334/4885

“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.