SCHEMBL31486288

SCHEMBL31486288

O=C(O)[C@@H]1CCc2cnc(NCC3CCOCC3)c(=O)n21

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TTK P33981 2/20 0.38
JAK2 O60674 1/20 0.38
JAK3 P52333 1/20 0.38
FLT3 P36888 1/20 0.37
SYK P43405 2/20 0.36
PDE5A O76074 5/20 0.36
FYN P06241 4/20 0.35
CSF1R P07333 1/20 0.35
VNN1 O95497 1/20 0.35
MAPK1 P28482 1/20 0.35
HIF1A Q16665 1/20 0.34
KCNH2 Q12809 1/20 0.33
ATM Q13315 1/20 0.33
ATR Q13535 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
SCHEMBL6073947 0.81 ACE (0.35) MAPK1HIF1A
SCHEMBL31486475 0.77 PREP (0.43) TTKVNN1MAPK1
SCHEMBL31486313 0.77 F2 (0.43)
SCHEMBL6734250 0.76 F2 (0.44) TTK
SCHEMBL7995908 0.76 F2 (0.48)
SCHEMBL31486384 0.75 MAPK14 (0.35) KCNH2
SCHEMBL6740598 0.72 F2 (0.46)
SCHEMBL31486336 0.72 AOC3 (0.42) HIF1A
SCHEMBL31486512 0.71 MAOB (0.38) SYKPDE5AMAPK1
SCHEMBL31486227 0.71 JAK3 (0.43) JAK3MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250122225-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION (US) 2025-04-17 US disclosed
WO-2025076476-A2 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION (US) 2025-04-10 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-20250122225-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, SPINT2, SERPINB1 TTK 591/4885JAK2 2616/4885JAK3 3987/4885

“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.