SCHEMBL20564609

SCHEMBL20564609

O=C(O)[C@@]12CCN(c3ncc(F)cn3)C[C@H]1C2

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 5/20 0.38
HCRTR2 O43614 2/20 0.37
BACE1 P56817 3/20 0.37
KDM4E B2RXH2 1/20 0.36
CYP2C19 P33261 1/20 0.36
RIPK1 Q13546 3/20 0.36
GPBAR1 Q8TDU6 1/20 0.36
KCNH2 Q12809 1/20 0.36
BACE2 Q9Y5Z0 1/20 0.36
HCRTR1 O43613 1/20 0.35
DRD4 P21917 3/20 0.35
DRD2 P14416 2/20 0.35
HTR1A P08908 1/20 0.35
HTR2A P28223 1/20 0.35

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
SCHEMBL20564611 1.00 SLC6A9 (0.38) SLC6A9HCRTR2BACE1KDM4ECYP2C19
SCHEMBL20564613 1.00 SLC6A9 (0.38) SLC6A9HCRTR2BACE1KDM4ECYP2C19
SCHEMBL21867154 1.00 SLC6A9 (0.38) SLC6A9HCRTR2BACE1KDM4ECYP2C19
SCHEMBL20565631 0.85 HCRTR2 (0.41) SLC6A9HCRTR2BACE1RIPK1GPBAR1
SCHEMBL20565632 0.85 HCRTR2 (0.41) SLC6A9HCRTR2BACE1RIPK1GPBAR1
SCHEMBL20565630 0.85 HCRTR2 (0.41) SLC6A9HCRTR2BACE1RIPK1GPBAR1
SCHEMBL20564809 0.76 RIPK1 (0.51) SLC6A9HCRTR2RIPK1GPBAR1HCRTR1
SCHEMBL20564811 0.75 RIPK1 (0.41) SLC6A9HCRTR2RIPK1GPBAR1HCRTR1
SCHEMBL21867306 0.74 POLB (0.41) KDM4ECYP2C19RIPK1DRD2HTR1A
SCHEMBL20565610 0.73 MEN1 (0.40) KDM4ECYP2C19RIPK1DRD2HTR1A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250011338-A1 Kinase Inhibitors and Uses Thereof DENALI THERAPEUTICS INC. (US) 2025-01-09 US disclosed
US-12129263-B2 Kinase inhibitors and uses thereof DENALI THERAPEUTICS INC. (US) 2024-10-29 US disclosed
US-20220041620-A1 Kinase Inhibitors and Uses Thereof DENALI THERAPEUTICS INC. (US) 2022-02-10 US disclosed
US-11203600-B2 Kinase inhibitors and uses thereof DENALI THERAPEUTICS INC. (US) 2021-12-21 US disclosed
EP-3624797-A1 KINASE INHIBITORS AND USES THEREOF Denali Therapeutics Inc. (US) 2020-03-25 EP disclosed
US-20200087319-A1 Kinase Inhibitors and Uses Thereof DENALI THERAPEUTICS INC. (US) 2020-03-19 US disclosed
WO-2018213632-A1 KINASE INHIBITORS AND USES THEREOF DENALI THERAPEUTICS INC. (US) 2018-11-22 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 (5 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-20250011338-A1 Kinase Inhibitors and Uses Thereof MAP3K20, MAP3K6, MAP3K19 SLC6A9 4727/4885HCRTR2 4856/4885BACE1 2536/4885
US-20200087319-A1 Kinase Inhibitors and Uses Thereof MAP3K20, MAP3K6, MAP3K19 SLC6A9 4727/4885HCRTR2 4856/4885BACE1 2536/4885
US-11203600-B2 Kinase inhibitors and uses thereof MAP3K20, MAP3K6, MAP3K19 SLC6A9 4727/4885HCRTR2 4856/4885BACE1 2536/4885
US-20220041620-A1 Kinase Inhibitors and Uses Thereof MAP3K20, MAP3K6, MAP3K19 SLC6A9 4727/4885HCRTR2 4856/4885BACE1 2536/4885
US-12129263-B2 Kinase inhibitors and uses thereof MAP3K20, MAP3K6, MAP3K19 SLC6A9 4727/4885HCRTR2 4856/4885BACE1 2536/4885

“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.