SCHEMBL29333343

SCHEMBL29333343

COc1cnc(C(C)C)nc1C

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 12/20 0.37
P2RX2 Q9UBL9 12/20 0.37
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
POLB P06746 1/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
PRNP P04156 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL22504228 0.82 PIK3C3 (0.33) TRPM8
SCHEMBL10566894 0.80 KMT2A (0.47) P2RX3P2RX2ALDH1A1L3MBTL1POLB
SCHEMBL19523196 0.80 P2RX3 (0.37) P2RX3P2RX2ALDH1A1L3MBTL1TRPM8
SCHEMBL25910808 0.78 P2RX3 (0.50) P2RX3P2RX2
SCHEMBL10691443 0.78 P2RX3 (0.36) P2RX3P2RX2ALDH1A1POLB
SCHEMBL30068102 0.78 P2RX3 (0.50) P2RX3P2RX2
SCHEMBL24943310 0.76 P2RX3 (0.35) P2RX3P2RX2ALDH1A1TRPM8MAPT
SCHEMBL10630156 0.75 ALDH1A1 (0.33) ALDH1A1
SCHEMBL12447891 0.74 APLNR (0.35) ALDH1A1MAPT
SCHEMBL2737354 0.74 APLNR (0.35)

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-20240226114-A1 INHIBITORS AND USES THEREOF VIVIDION THERAPEUTICS, INC. 2024-07-11 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-20240226114-A1 INHIBITORS AND USES THEREOF KEAP1, NQO1, NFE2L2 P2RX3 4602/4885P2RX2 4559/4885ALDH1A1 1020/4885

“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.