SCHEMBL21044544

SCHEMBL21044544

N#Cc1cncc(-c2ccc(N)nc2)n1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 6/20 0.52
CYP11B1 P15538 5/20 0.52
PIK3CD O00329 3/20 0.46
MKNK1 Q9BUB5 1/20 0.39
MKNK2 Q9HBH9 1/20 0.39
IRAK4 Q9NWZ3 1/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPK1 P28482 1/20 0.37
PIK3CG P48736 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
LTA4H P09960 1/20 0.37
MAP4K4 O95819 1/20 0.37
CDK5 Q00535 1/20 0.35
CDK5R1 Q15078 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL21044154 0.81 CYP11B2 (0.56) CYP11B2CYP11B1IRAK4MEN1NPC1
SCHEMBL21044087 0.75 PIK3CD (0.56) CYP11B2CYP11B1PIK3CDMKNK1MKNK2
SCHEMBL23121297 0.75 MKNK1 (0.46) PIK3CDMKNK1MKNK2MEN1NPC1
SCHEMBL13097164 0.75 CYP11B1 (0.44) CYP11B2CYP11B1PIK3CDMKNK1MKNK2
SCHEMBL8070286 0.74 CYP11B2 (0.55) CYP11B2CYP11B1IRAK4MEN1RAB9A
SCHEMBL21044075 0.74 CYP11B2 (0.56) CYP11B2CYP11B1IRAK4NPC1RAB9A
SCHEMBL21044056 0.74 CYP11B2 (0.63) CYP11B2CYP11B1IRAK4MAPT
SCHEMBL22869136 0.74 CYP11B2 (0.72) CYP11B2CYP11B1IRAK4
SCHEMBL30338462 0.73 CYP11B2 (0.51) CYP11B2CYP11B1MKNK1MKNK2KDM4E
SCHEMBL28145764 0.73 CYP11B1 (0.55) CYP11B2CYP11B1MKNK1MKNK2IRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3717459-B1 COMPOUNDS STEP PHARMA S A S (FR) 2026-01-21 EP disclosed
US-11655246-B2 Aminothiazole compounds as inhibitors of CTPS1 STEP PHARMA S.A.S. (FR) 2023-05-23 US disclosed
US-20210002269-A1 COMPOUNDS STEP PHARMA S.A.S. (FR) 2021-01-07 US disclosed
EP-3492454-A1 COMPOUNDS Step Pharma S.A.S. (FR) 2019-06-05 EP disclosed
EP-3492454-A1 COMPOUNDS Step Pharma S.A.S. (FR) 2019-06-05 EP 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-11655246-B2 Aminothiazole compounds as inhibitors of CTPS1 CTPS1, CTPS2, TBXAS1 CYP11B2 1869/4885CYP11B1 1418/4885PIK3CD 2075/4885
US-20210002269-A1 COMPOUNDS UGT1A1, CYP1A1, CYP19A1 CYP11B2 6/4885CYP11B1 5/4885PIK3CD 3859/4885

“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.