SCHEMBL19659596

SCHEMBL19659596

CC1CCn2nc(CC3CCOCC3)cc2N(C)C1=O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.47
HTR6 P50406 5/20 0.38
BRD4 O60885 3/20 0.37
CCL2 P13500 1/20 0.37
CYP2C19 P33261 2/20 0.36
KCNH2 Q12809 2/20 0.36
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
GRM5 P41594 2/20 0.32
BAZ2A Q9UIF9 1/20 0.30
CNR1 P21554 2/20 0.30
CNR2 P34972 2/20 0.30
NLRP3 Q96P20 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
SCHEMBL18367458 0.87 RIPK1 (0.47) RIPK1HTR6BRD4CCL2CYP2C19
SCHEMBL18367457 0.87 RIPK1 (0.47) RIPK1HTR6BRD4CCL2CYP2C19
SCHEMBL18367459 0.82 RIPK1 (0.44) RIPK1HTR6BRD4CCL2CYP2C19
SCHEMBL18367456 0.82 RIPK1 (0.42) RIPK1HTR6BRD4CCL2CYP2C19
SCHEMBL20262416 0.81 RIPK1 (0.53) RIPK1HTR6CYP2C19KCNH2GRM5
SCHEMBL20262317 0.81 RIPK1 (0.53) RIPK1HTR6CYP2C19KCNH2GRM5
SCHEMBL19659572 0.79 RIPK1 (0.39) RIPK1HTR6BRD4
SCHEMBL19659469 0.79 RIPK1 (0.35) RIPK1GRM5
SCHEMBL18365813 0.78 RIPK1 (0.40) RIPK1HTR6CYP3A4GRM5
SCHEMBL19659443 0.77 GRM5 (0.33) RIPK1HTR6GRM5CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10988459-B2 Bicyclic lactams and methods of use thereof GENENTECH, INC. (US) 2021-04-27 US disclosed
EP-3760625-A1 BICYCLIC LACTAMS AS RECEPTOR-INTERACTING PROTEIN-1 (RIP1) KINASE INHIBITORS FOR TREATING E.G. INFLAMMATORY DISEASES F. Hoffmann-La Roche AG (CH) 2021-01-06 EP disclosed
WO-2017004500-A9 BICYCLIC LACTAMS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-11-30 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 (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-10988459-B2 Bicyclic lactams and methods of use thereof LSS, LPXN, CYP1B1 RIPK1 3064/4885HTR6 4650/4885BRD4 785/4885

“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.