SCHEMBL23913769

SCHEMBL23913769

NC(=O)c1cc(Oc2ccc(F)cc2)ccn1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 1/20 0.53
SCN9A Q15858 15/20 0.53
RAF1 P04049 2/20 0.53
HRH3 Q9Y5N1 1/20 0.53
FPR2 P25090 3/20 0.47
GRM5 P41594 1/20 0.47

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
SCHEMBL29757282 1.00 P2RX3 (0.53) P2RX3SCN9ARAF1HRH3FPR2
SCHEMBL2427202 0.86 P2RX3 (0.52) P2RX3SCN9ARAF1HRH3GRM5
SCHEMBL4369342 0.86 PARP10 (0.54) P2RX3RAF1
SCHEMBL177841 0.86 PARP10 (0.54) P2RX3RAF1
SCHEMBL23900346 0.85 USP2 (0.50) P2RX3SCN9ARAF1GRM5
SCHEMBL29757280 0.85 USP2 (0.50) P2RX3SCN9ARAF1GRM5
SCHEMBL6273015 0.84 RAF1 (0.50) P2RX3RAF1HRH3
SCHEMBL23900111 0.84 HRH3 (0.50) P2RX3RAF1HRH3GRM5
SCHEMBL257959 0.84 RAF1 (0.50) P2RX3RAF1
SCHEMBL4155509 0.84 PARP10 (0.51) RAF1HRH3GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11584758-B2 RIP1K inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2023-02-21 US disclosed
US-20210317135-A1 RIP1K INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2021-10-14 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 (2 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-11584758-B2 RIP1K inhibitors RIPK1, RIPK2, RIPK3 P2RX3 3426/4885SCN9A 3587/4885RAF1 60/4885
US-20210317135-A1 RIP1K INHIBITORS RIPK1, RIPK2, RIPK3 P2RX3 3426/4885SCN9A 3587/4885RAF1 60/4885

“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.