SCHEMBL18366144

SCHEMBL18366144

COC(=O)c1cc2c(cn1)COC2(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 2/20 0.46
LCK P06239 1/20 0.42
MAPK1 P28482 3/20 0.40
GABRA1 P14867 4/20 0.37
GABRG2 P18507 4/20 0.37
GABRB3 P28472 4/20 0.37
GABRA5 P31644 4/20 0.37
GABRA3 P34903 4/20 0.37
GABRA2 P47869 4/20 0.37
GABRP O00591 3/20 0.37
GABRD O14764 3/20 0.37
GABRB1 P18505 3/20 0.37
GABRB2 P47870 3/20 0.37
GABRA4 P48169 3/20 0.37
GABRE P78334 3/20 0.37
GABRA6 Q16445 3/20 0.37
GABRG1 Q8N1C3 3/20 0.37
GABRG3 Q99928 3/20 0.37
GABRQ Q9UN88 3/20 0.37
ALDH1A1 P00352 2/20 0.37

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
SCHEMBL30587492 1.00 RIPK1 (0.46) RIPK1LCKMAPK1GABRA1GABRG2
SCHEMBL30015041 0.84 RIPK1 (0.63) RIPK1LCKMAPK1GABRA1GABRG2
SCHEMBL18366136 0.84 RIPK1 (0.63) RIPK1LCKMAPK1GABRA1GABRG2
SCHEMBL18366510 0.84 RIPK1 (0.41) RIPK1LCKMAPK1GABRA1GABRG2
SCHEMBL18365947 0.84 RIPK1 (0.46) RIPK1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL30587542 0.84 RIPK1 (0.46) RIPK1ALDH1A1KDM4EMAPTKMT2A
SCHEMBL30092704 0.83 RIPK1 (0.50) RIPK1LCKMAPK1GABRA1GABRG2
SCHEMBL30587469 0.83 RIPK1 (0.42) RIPK1LCKMAPK1GABRA1GABRG2
SCHEMBL18366444 0.83 RIPK1 (0.50) RIPK1LCKMAPK1GABRA1GABRG2
SCHEMBL18367362 0.83 RIPK1 (0.42) RIPK1LCKMAPK1GABRA1GABRG2

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 5 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
US-20170008877-A1 BICYCLIC LACTAMS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-01-12 US disclosed
US-20170008877-A1 BICYCLIC LACTAMS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-01-12 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-10988459-B2 Bicyclic lactams and methods of use thereof LSS, LPXN, CYP1B1 RIPK1 3064/4885LCK 4712/4885MAPK1 4237/4885
US-20170008877-A1 BICYCLIC LACTAMS AND METHODS OF USE THEREOF LSS, LPXN, CYP1B1 RIPK1 3064/4885LCK 4712/4885MAPK1 4237/4885

“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.