SCHEMBL19805319

SCHEMBL19805319

CC(C)(C)c1cc(C#N)ccc1Oc1ccc(N2C(=O)NC(C)(C)C2O)cn1

nearest known ligand 0.31

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.31
SYK P43405 1/20 0.31
MAPK12 P53778 1/20 0.31
TRPV4 Q9HBA0 1/20 0.31
ESRRB O95718 1/20 0.30
ESR1 P03372 1/20 0.30
ESRRA P11474 1/20 0.30
ESRRG P62508 1/20 0.30
ESR2 Q92731 1/20 0.30
HSD11B1 P28845 1/20 0.30
HSD11B2 P80365 1/20 0.30
NR3C1 P04150 1/20 0.30
SSTR4 P31391 1/20 0.30
CNR2 P34972 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
SCHEMBL1979175 0.80 AR (0.44) SRCSYKMAPK12ESRRBESR1
SCHEMBL18952970 0.80 AR (0.36) SRCSYKMAPK12TRPV4ESRRB
SCHEMBL18952957 0.80 ROCK2 (0.31) SRCSYKMAPK12TRPV4ESRRB
SCHEMBL30939539 0.78 ELANE (0.35) TRPV4ESRRBESR1ESRRAESRRG
SCHEMBL1979370 0.78 ELANE (0.35) TRPV4ESRRBESR1ESRRAESRRG
SCHEMBL18952974 0.76 MMP13 (0.33) SRCSYKMAPK12TRPV4ESRRB
SCHEMBL19011617 0.76 AR (0.35) SRCSYKMAPK12ESRRBESR1
SCHEMBL19805323 0.75 PTGDR2 (0.38) TRPV4HSD11B1HSD11B2NR3C1
SCHEMBL1979583 0.74 ELANE (0.33) SRCSYKMAPK12HSD11B1SSTR4
SCHEMBL29437994 0.74 ELANE (0.33) SRCSYKMAPK12HSD11B1SSTR4

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-20180021336-A1 IMIDAZOLIDINEDIONE DERIVATIVES AUTIFONY THERAPEUTICS LIMITED (GB) 2018-01-25 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-20180021336-A1 IMIDAZOLIDINEDIONE DERIVATIVES KCND3, KCNK3, KCNA3 SRC 4241/4885SYK 3336/4885MAPK12 1951/4885

“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.