SCHEMBL29333344

SCHEMBL29333344

COc1nc(C(C)C)ncc1N

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.35
CASP1 P29466 1/20 0.35
PIK3CA P42336 2/20 0.35
AURKA O14965 1/20 0.34
TTK P33981 1/20 0.34
AURKB Q96GD4 1/20 0.34
INCENP Q9NQS7 1/20 0.34
P2RX3 P56373 8/20 0.33
P2RX2 Q9UBL9 8/20 0.33
TKT P29401 1/20 0.33
POLB P06746 2/20 0.31
PDCD1 Q15116 2/20 0.31
CD274 Q9NZQ7 2/20 0.31
GAA P10253 1/20 0.30
GFER P55789 1/20 0.30

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
SCHEMBL15431031 0.81 PIK3CA (0.33) PIK3CAAURKAP2RX3P2RX2GAA
SCHEMBL12235181 0.80 P2RX3 (0.35) PIK3CAP2RX3P2RX2CD274
SCHEMBL10566894 0.78 KMT2A (0.47) P2RX3P2RX2POLB
SCHEMBL12413949 0.77 GAA (0.37) P2RX3P2RX2GAA
SCHEMBL22630761 0.77 LRRK2 (0.37) P2RX3P2RX2PDCD1CD274
SCHEMBL1785253 0.75 POLB (0.40) P2RX3P2RX2TKTPOLB
SCHEMBL7891452 0.75 NUDT1 (0.44) MAPTCASP1PIK3CAAURKATTK
SCHEMBL3192300 0.74 PLAU (0.40) MAPTCASP1PIK3CAAURKATTK
SCHEMBL30399803 0.74 PLAU (0.40) MAPTCASP1PIK3CAAURKATTK
SCHEMBL29333345 0.74 UHRF1 (0.35) TKTPOLB

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 3 patents. 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
US-20240226114-A1 INHIBITORS AND USES THEREOF VIVIDION THERAPEUTICS, INC. 2024-07-11 US disclosed
WO-2024073587-A1 N-ACRYLOYLMORPHOLINE DERIVATIVES AS KEAP1 MODULATORS AND USES THEREOF VIVIDION THERAPEUTICS, INC. (US) 2024-04-04 WO 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 MAPT 2380/4885CASP1 2524/4885PIK3CA 3512/4885

“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.