SCHEMBL25302152

SCHEMBL25302152

CCOC(=O)C1(F)CCN(c2nccc(C#N)n2)CC1(F)F

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 3/20 0.43
PANK3 Q9H999 1/20 0.40
ACACB O00763 7/20 0.38
RET P07949 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
CHRM2 P08172 1/20 0.35
CTSS P25774 2/20 0.35
GRM5 P41594 1/20 0.35
CRBN Q96SW2 1/20 0.34

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
SCHEMBL30339347 1.00 RIPK1 (0.43) RIPK1PANK3ACACBRETNR1H2
SCHEMBL25294807 0.84 RIPK1 (0.47) RIPK1PANK3ACACBNR1H2NR1H3
SCHEMBL30338972 0.82 RIPK1 (0.43) RIPK1PANK3ACACBNR1H2NR1H3
SCHEMBL20565724 0.76 RIPK1 (0.44) RIPK1
SCHEMBL21868480 0.72 RIPK1 (0.55) RIPK1PANK3ACACBNR1H2NR1H3
SCHEMBL22389879 0.70 PANK3 (0.50) RIPK1PANK3ACACBCHRM2CTSS
SCHEMBL25262820 0.69 RIPK1 (0.45) RIPK1PANK3CHRM2CTSS
SCHEMBL28671204 0.69 PANK3 (0.47) RIPK1PANK3ACACBCHRM2CTSS
SCHEMBL30547508 0.69 KDM4E (0.41) PANK3ACACBCHRM2CTSS
SCHEMBL25296464 0.66 CRBN (0.41) NR1H2NR1H3CRBN

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-20230219937-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF SANOFI (FR) 2023-07-13 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-20230219937-A1 ISOXAZOLIDINES AS RIPK1 INHIBITORS AND USE THEREOF RIPK1, RIPK4, RIPK2 RIPK1 1/4885PANK3 202/4885ACACB 4218/4885

“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.