SCHEMBL20565632

SCHEMBL20565632

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

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 2/20 0.41
HCRTR1 O43613 1/20 0.39
CYP3A4 P08684 1/20 0.39
DRD4 P21917 4/20 0.37
DRD2 P14416 3/20 0.37
HTR1A P08908 1/20 0.37
HTR2A P28223 1/20 0.37
GPBAR1 Q8TDU6 1/20 0.36
SLC6A9 P48067 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B10 Q99714 1/20 0.35
OPRK1 P41145 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
RIPK1 Q13546 1/20 0.34
CTSD P07339 1/20 0.34
BACE1 P56817 1/20 0.34
KCNH2 Q12809 1/20 0.34
BACE2 Q9Y5Z0 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
SCHEMBL20565630 1.00 HCRTR2 (0.41) HCRTR2HCRTR1CYP3A4DRD4DRD2
SCHEMBL20565631 1.00 HCRTR2 (0.41) HCRTR2HCRTR1CYP3A4DRD4DRD2
SCHEMBL20564611 0.85 SLC6A9 (0.38) HCRTR2HCRTR1DRD4DRD2HTR1A
SCHEMBL21867154 0.85 SLC6A9 (0.38) HCRTR2HCRTR1DRD4DRD2HTR1A
SCHEMBL20564613 0.85 SLC6A9 (0.38) HCRTR2HCRTR1DRD4DRD2HTR1A
SCHEMBL20564609 0.85 SLC6A9 (0.38) HCRTR2HCRTR1DRD4DRD2HTR1A
SCHEMBL20565202 0.69 HCRTR2 (0.42) HCRTR2HCRTR1DRD4DRD2HTR1A
SCHEMBL21868475 0.69 CYP3A4 (0.44) HCRTR2HCRTR1CYP3A4HTR1ASIGMAR1
SCHEMBL21867147 0.68 RIPK1 (0.41) HCRTR2HCRTR1DRD4HTR1AHTR2A
SCHEMBL20565643 0.68 RIPK1 (0.45) HCRTR2HCRTR1GPBAR1SIGMAR1RIPK1

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 8 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
CN-110913858-A Kinase inhibitors and uses thereof 戴纳立制药公司 2020-03-24 CN 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 HCRTR2 4856/4885HCRTR1 4870/4885CYP3A4 3925/4885
US-20200087319-A1 Kinase Inhibitors and Uses Thereof MAP3K20, MAP3K6, MAP3K19 HCRTR2 4856/4885HCRTR1 4870/4885CYP3A4 3925/4885
US-11203600-B2 Kinase inhibitors and uses thereof MAP3K20, MAP3K6, MAP3K19 HCRTR2 4856/4885HCRTR1 4870/4885CYP3A4 3925/4885
US-20220041620-A1 Kinase Inhibitors and Uses Thereof MAP3K20, MAP3K6, MAP3K19 HCRTR2 4856/4885HCRTR1 4870/4885CYP3A4 3925/4885
US-12129263-B2 Kinase inhibitors and uses thereof MAP3K20, MAP3K6, MAP3K19 HCRTR2 4856/4885HCRTR1 4870/4885CYP3A4 3925/4885

“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.