SCHEMBL25147461

SCHEMBL25147461

CCc1ccc(F)c(C2CCOCC2)c1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RPS6KA3 P51812 1/20 0.38
PDE2A O00408 4/20 0.38
OPRL1 P41146 5/20 0.38
KIF11 P52732 1/20 0.37
GAA P10253 1/20 0.36
CCR2 P41597 1/20 0.35
SOS1 Q07889 1/20 0.34
MAOA P21397 1/20 0.34
AKT1 P31749 1/20 0.33
MEN1 O00255 1/20 0.33
CASP6 P55212 1/20 0.33
KMT2A Q03164 1/20 0.33
HKDC1 Q2TB90 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 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
SCHEMBL18295013 0.88 SOS1 (0.40) OPRL1KIF11SOS1SLC6A2SLC6A4
SCHEMBL22502738 0.87 OPRL1 (0.45) RPS6KA3PDE2AOPRL1KIF11GAA
SCHEMBL765783 0.85 BACE1 (0.41) OPRL1KIF11SOS1
SCHEMBL14297935 0.85 BACE1 (0.44) OPRL1KIF11SOS1
SCHEMBL14314452 0.83 NUDT1 (0.46) OPRL1KIF11SOS1
SCHEMBL21644870 0.78 ESR1 (0.39) OPRL1SOS1
SCHEMBL20103372 0.78 ESR1 (0.39) OPRL1SOS1
SCHEMBL16220939 0.78 PLK4 (0.41) OPRL1GAA
SCHEMBL21533899 0.77 SYK (0.45)
SCHEMBL8264162 0.77 OPRL1 (0.38) RPS6KA3PDE2AOPRL1MAOA

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-20230117631-A1 HPK1 ANTAGONISTS AND USES THEREOF Nimbus Saturn, Inc. 2023-04-20 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-20230117631-A1 HPK1 ANTAGONISTS AND USES THEREOF PDXK, HIPK1, PCK1 RPS6KA3 253/4885PDE2A 2297/4885OPRL1 2329/4885

“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.