SCHEMBL30076404

SCHEMBL30076404

OC(c1nc2c(N3CCOCC3)nc(Cl)nc2[nH]1)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.34
SLC29A1 Q99808 1/20 0.32
HDAC1 Q13547 1/20 0.32
PIK3R1 P27986 1/20 0.32
PIK3CA P42336 1/20 0.32
P2RX3 P56373 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
PDE2A O00408 1/20 0.30
AKT1 P31749 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
SCHEMBL9937339 1.00 SMN1; SMN2 (0.34) SMN1; SMN2SLC29A1HDAC1PIK3R1PIK3CA
SCHEMBL30670395 0.79 SLC29A1 (0.40) SMN1; SMN2SLC29A1HDAC1PIK3R1PIK3CA
SCHEMBL10008467 0.78 SMN1; SMN2 (0.38) SMN1; SMN2HDAC1PIK3R1PIK3CALMNA
SCHEMBL9936755 0.77 SMN1; SMN2 (0.37) SMN1; SMN2SLC29A1HDAC1PIK3R1PIK3CA
SCHEMBL3325399 0.76 SMN1; SMN2 (0.41) SMN1; SMN2SLC29A1HDAC1PIK3R1PIK3CA
SCHEMBL18050658 0.74
SCHEMBL1113965 0.74 SMN1; SMN2 (0.38) SMN1; SMN2SLC29A1HDAC1PIK3R1PIK3CA
SCHEMBL30670406 0.74 SMN1; SMN2 (0.38) SMN1; SMN2SLC29A1HDAC1PIK3R1PIK3CA
SCHEMBL25229494 0.74 SMN1; SMN2 (0.42) SMN1; SMN2SLC29A1HDAC1NPSR1MAPT
SCHEMBL31339118 0.74 PIM1 (0.40) SMN1; SMN2SLC29A1HDAC1PIK3R1PIK3CA

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-20220348593-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE GENENTECH, INC. 2022-11-03 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-20220348593-A1 TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE PIK3CA, PIK3CD, MTOR SMN1; SMN2 3443/4885SLC29A1 1169/4885HDAC1 298/4885

“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.