SCHEMBL19971955

SCHEMBL19971955

Cc1ccc(N2CCN(C(=O)c3ccc(NC(N)=O)cc3)C(c3ccccc3)C2)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 6/20 0.44
ATM Q13315 1/20 0.43
SLC6A9 P48067 4/20 0.42
EIF4A3 P38919 2/20 0.41
HSP90AA1 P07900 1/20 0.41
TP53 P04637 2/20 0.40
NR1H2 P55055 3/20 0.40
NR1H3 Q13133 3/20 0.40
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL19985024 0.86 SLC6A9 (0.43) P2RX7SLC6A9EIF4A3NR1H2NR1H3
SCHEMBL19971958 0.79 MAPT (0.47) ATMTP53MAPTSMN1; SMN2
SCHEMBL19985023 0.72 SLC6A9 (0.47) SLC6A9EIF4A3NR1H2NR1H3POLB
SCHEMBL18286135 0.69 HSP90AA1 (0.52) P2RX7ATMHSP90AA1
SCHEMBL15506284 0.68 MAPT (0.69) POLBMAPTSMN1; SMN2
SCHEMBL19985025 0.68 ABCB1 (0.43) P2RX7ATMEIF4A3MAPT
SCHEMBL14257956 0.66 P2RX7 (0.60) P2RX7TP53MAPTSMN1; SMN2
SCHEMBL3183964 0.66 ALDH1A1 (0.63) MAPTSMN1; SMN2
SCHEMBL18283321 0.65 PREP (0.62) ATMHSP90AA1POLB
SCHEMBL19710253 0.65 NOTUM (0.54) SLC6A9NR1H2NR1H3

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-20180079730-A1 ANTI-PCSK9 COMPOUNDS AND METHODS FOR THE TREATMENT AND/OR PREVENTION OF CARDIOVASCULAR DISEASES SHIFA BIOMEDICAL CORP (US) 2018-03-22 US claimed

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-20180079730-A1 ANTI-PCSK9 COMPOUNDS AND METHODS FOR THE TREATMENT AND/OR PREVENTION OF CARDIOVASCULAR DISEASES PCSK9, PCSK7, PCSK6 P2RX7 4831/4885ATM 2396/4885SLC6A9 4318/4885

“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.