SCHEMBL23949853

SCHEMBL23949853

COc1ccc(C(=O)NCC23CC4(F)CC(F)(CC(F)(C4)C2)C3)c(Cl)c1

nearest known ligand 0.83

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 11/20 0.83
P2RY12 Q9H244 1/20 0.83
FLT1 P17948 1/20 0.48
FLT4 P35916 1/20 0.48
KDR P35968 1/20 0.48
JAK2 O60674 1/20 0.47
TYK2 P29597 1/20 0.47
TNKS O95271 2/20 0.46
TNKS2 Q9H2K2 2/20 0.46
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
KDM4E B2RXH2 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
CLPP Q16740 1/20 0.41

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
SCHEMBL21753383 0.91 P2RX7 (1.00) P2RX7P2RY12TYK2MEN1KMT2A
SCHEMBL23949843 0.89 P2RX7 (0.85) P2RX7P2RY12FLT1FLT4KDR
SCHEMBL23949851 0.86 P2RX7 (0.85) P2RX7P2RY12
SCHEMBL23950061 0.80 P2RX7 (0.56) P2RX7P2RY12FLT1FLT4KDR
SCHEMBL21753384 0.80 P2RX7 (1.00) P2RX7P2RY12
SCHEMBL23949982 0.79 P2RX7 (0.65) P2RX7P2RY12MAPT
SCHEMBL21753443 0.77 P2RX7 (1.00) P2RX7P2RY12
SCHEMBL23949841 0.76 P2RX7 (0.61) P2RX7P2RY12JAK2MEN1KMT2A
SCHEMBL31450913 0.74 P2RX7 (0.69) P2RX7P2RY12
SCHEMBL23949847 0.74 P2RX7 (0.58) P2RX7P2RY12

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-20210323910-A1 ADAMANTANYL-SUBSTITUTED BENZAMIDE COMPOUNDS AND THEIR USE AS P2X7 RECEPTOR ANTAGONISTS THE UNIVERSITY OF SYDNEY (AU) 2021-10-21 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-20210323910-A1 ADAMANTANYL-SUBSTITUTED BENZAMIDE COMPOUNDS AND THEIR USE AS P2X7 RECEPTOR ANTAGONISTS P2RX1, P2RX3, P2RX5 P2RX7 4/4885P2RY12 14/4885FLT1 1987/4885

“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.