SCHEMBL31455169

SCHEMBL31455169

COC(=O)c1ccc(Nc2nc(-c3ccccc3)ccc2N)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 2/20 0.61
PDE5A O76074 2/20 0.61
ABCC1 P33527 1/20 0.61
MAPT P10636 5/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
TP53 P04637 2/20 0.54
ALDH1A1 P00352 4/20 0.50
HPGD P15428 3/20 0.50
KDM4E B2RXH2 3/20 0.50
GAA P10253 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KDR P35968 2/20 0.48
ROCK1 Q13464 1/20 0.47
ALDH1A3 P47895 1/20 0.46
SIRT2 Q8IXJ6 1/20 0.46
ALOX5 P09917 1/20 0.46
ALOX12 P18054 1/20 0.46
GLA P06280 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL25385310 1.00 ABCG2 (0.61) ABCG2PDE5AABCC1MAPTMEN1
SCHEMBL3647967 0.85 ADORA3 (0.52) ABCG2PDE5AABCC1MAPTALDH1A1
SCHEMBL31455120 0.83 PDE5A (0.43) ABCG2PDE5AABCC1MAPTMEN1
SCHEMBL31455225 0.82 NPC1 (0.44) ABCG2PDE5AABCC1MAPTMEN1
SCHEMBL25384573 0.81 ABCG2 (0.54) ABCG2PDE5AABCC1MAPTMEN1
SCHEMBL31454989 0.81 ABCG2 (0.54) ABCG2PDE5AABCC1MAPTMEN1
SCHEMBL12172514 0.81 MKNK2 (0.53) ABCG2PDE5AMAPTMEN1KMT2A
SCHEMBL30815683 0.78 MAPT (0.45) ABCG2PDE5AABCC1MAPTMEN1
SCHEMBL27227194 0.78 MAPT (0.45) ABCG2PDE5AABCC1MAPTMEN1
SCHEMBL29324971 0.77 ROCK1 (0.49) ABCG2PDE5AABCC1MAPTMEN1

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-20250115600-A1 COVALENT MODIFIERS OF AKT1 AND USES THEREOF TERREMOTO BIOSCIENCES, INC. 2025-04-10 US disclosed
WO-2025059562-A1 SUBSTITUTED AMINOPYRIDINE COMPOUNDS AND METHODS OF TREATING DISEASE USING SAME ATAVISTIK BIO, INC. (US) 2025-03-20 WO disclosed
WO-2025059577-A1 SUBSTITUTED AMINOPYRIDINE COMPOUNDS FOR USE AS AKT1 INHIBITORS ATAVISTIK BIO, INC. (US) 2025-03-20 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-20250115600-A1 COVALENT MODIFIERS OF AKT1 AND USES THEREOF AKT1, AKT1S1, AKT2 ABCG2 4167/4885PDE5A 3049/4885ABCC1 4221/4885

“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.