SCHEMBL31486352

SCHEMBL31486352

Cc1cc(F)cc(CNc2nc(C#N)c3n(c2=O)[C@H](C(=O)O)CC3)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RPS6KB1 P23443 1/20 0.37
PREP P48147 9/20 0.35
ACE P12821 2/20 0.34
HTT P42858 1/20 0.32
F7 P08709 1/20 0.32
F3 P13726 1/20 0.32
OGFRL1 Q5TC84 2/20 0.31
PDE5A O76074 1/20 0.31
OPRM1 P35372 1/20 0.31
OPRK1 P41145 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
MAPT P10636 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
SCHEMBL31486419 0.86 F7 (0.41) RPS6KB1PREPACEF7F3
SCHEMBL31486531 0.85 RPS6KB1 (0.36) RPS6KB1PREPACEF7F3
SCHEMBL31486338 0.83 PREP (0.36) RPS6KB1PREPACEF7F3
Trifluoroacetic Acid SCHEMBL31486505 0.81 TPSAB1 (0.40)
SCHEMBL31486244 0.80 MET (0.37) RPS6KB1PREPACEF7F3
SCHEMBL31486440 0.80 PREP (0.36) RPS6KB1PREPACEF7F3
SCHEMBL31486191 0.80 PREP (0.36) RPS6KB1PREPACEF7F3
SCHEMBL31486238 0.79 F7 (0.43) PREPACEF7F3KDM4E
SCHEMBL31486546 0.79 RPS6KB1 (0.39) RPS6KB1PREP
SCHEMBL31486537 0.79 RPS6KB1 (0.39) RPS6KB1PREPACE

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 RPS6KB1 2675/4885PREP 140/4885ACE 167/4885

“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.