SCHEMBL21867151

SCHEMBL21867151

O=C(O)[C@@H]1CCN(c2ncc(F)cn2)C[C@H]1F

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 7/20 0.53
SLC6A9 P48067 6/20 0.41
KDM4E B2RXH2 1/20 0.41
CYP2C19 P33261 1/20 0.41
GPBAR1 Q8TDU6 1/20 0.39
HCRTR2 O43614 2/20 0.39
HCRTR1 O43613 1/20 0.39
NOTUM Q6P988 1/20 0.38
SIGMAR1 Q99720 1/20 0.38

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
SCHEMBL21868478 0.84 RIPK1 (0.45) RIPK1SLC6A9KDM4ECYP2C19HCRTR2
SCHEMBL15751660 0.77 KDM4E (0.68) RIPK1SLC6A9KDM4ECYP2C19NOTUM
SCHEMBL25294414 0.76 RBP4 (0.38) RIPK1KDM4E
SCHEMBL25294415 0.76 RBP4 (0.38) RIPK1KDM4E
SCHEMBL31311132 0.76 RIPK1 (0.42) RIPK1SLC6A9HCRTR2HCRTR1SIGMAR1
SCHEMBL20188739 0.75 KDM4E (0.58) RIPK1SLC6A9KDM4ECYP2C19GPBAR1
SCHEMBL16872992 0.73 MKNK1 (0.43) RIPK1SLC6A9SIGMAR1
SCHEMBL16872993 0.73 MKNK1 (0.43) RIPK1SLC6A9SIGMAR1
SCHEMBL21868474 0.72 KDM4E (0.60) RIPK1KDM4ECYP2C19GPBAR1HCRTR2
SCHEMBL20565035 0.72 RIPK1 (0.42) RIPK1SLC6A9GPBAR1HCRTR2HCRTR1

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-11203600-B2 Kinase inhibitors and uses thereof DENALI THERAPEUTICS INC. (US) 2021-12-21 US disclosed
US-20200087319-A1 Kinase Inhibitors and Uses Thereof DENALI THERAPEUTICS INC. (US) 2020-03-19 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 (2 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-20200087319-A1 Kinase Inhibitors and Uses Thereof MAP3K20, MAP3K6, MAP3K19 RIPK1 353/4885SLC6A9 4727/4885KDM4E 1312/4885
US-11203600-B2 Kinase inhibitors and uses thereof MAP3K20, MAP3K6, MAP3K19 RIPK1 353/4885SLC6A9 4727/4885KDM4E 1312/4885

“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.