SCHEMBL18366395

SCHEMBL18366395

O=C1CCOC(c2ccc(F)cc2F)C1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
GRM2 Q14416 4/20 0.34
BACE1 P56817 1/20 0.34
MAOB P27338 6/20 0.33
OPRL1 P41146 1/20 0.33
FADS1 O60427 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL18366390 0.77 MAOB (0.43) MAOBFADS1
SCHEMBL12303672 0.74 HTR2A (0.49) HTR2AHTR2CHTR2BBACE1OPRL1
SCHEMBL29595508 0.74 HTR2A (0.49) HTR2AHTR2CHTR2BBACE1OPRL1
SCHEMBL1121711 0.74 HTR2A (0.49) HTR2AHTR2CHTR2BBACE1OPRL1
SCHEMBL20013058 0.73 HTR2A (0.42) HTR2AHTR2CHTR2BBACE1OPRL1
SCHEMBL13749069 0.73 HTR2A (0.42) HTR2AHTR2CHTR2BBACE1OPRL1
SCHEMBL30587569 0.73 HTR2A (0.34) HTR2AHTR2CHTR2BMAOB
SCHEMBL18366392 0.73 HTR2A (0.34) HTR2AHTR2CHTR2BMAOB
SCHEMBL9337391 0.72 HTR2A (0.41) HTR2AHTR2CHTR2BBACE1OPRL1
SCHEMBL10306261 0.72 GRM2 (0.41) HTR2AHTR2CHTR2BGRM2OPRL1

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
CN-111269221-B Bicyclic lactams and methods of use thereof 豪夫迈·罗氏有限公司 2023-09-26 CN disclosed
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
WO-2017004500-A1 BICYCLIC LACTAMS AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-01-05 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 (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 HTR2A 3967/4885HTR2C 3044/4885HTR2B 2906/4885
US-20170008877-A1 BICYCLIC LACTAMS AND METHODS OF USE THEREOF LSS, LPXN, CYP1B1 HTR2A 3967/4885HTR2C 3044/4885HTR2B 2906/4885

“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.