SCHEMBL18050720

SCHEMBL18050720

CC(C)(O)c1nc2c(N3CCCC3)nc(Cl)nc2n1C1CCCCO1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 1/20 0.39
PIK3CA P42336 2/20 0.33
MTOR P42345 2/20 0.33
PIK3CD O00329 2/20 0.33
ATR Q13535 1/20 0.33
PDE10A Q9Y233 2/20 0.30
NT5E P21589 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
SCHEMBL1114173 0.94 PIK3CD (0.40) YTHDC1PIK3CAMTORPIK3CDATR
SCHEMBL31372903 0.94 PIK3CD (0.40) YTHDC1PIK3CAMTORPIK3CDATR
SCHEMBL10262783 0.88 YTHDC1 (0.37) YTHDC1PIK3CAMTORPIK3CDATR
SCHEMBL9936929 0.85 YTHDC1 (0.42) YTHDC1ATR
SCHEMBL9937128 0.84 PIK3CD (0.36) YTHDC1PIK3CAMTORPIK3CDATR
SCHEMBL20903687 0.83 YTHDC1 (0.42) YTHDC1PDE10A
SCHEMBL18050669 0.83 YTHDC1 (0.36) YTHDC1
SCHEMBL19242068 0.82 YTHDC1 (0.35) YTHDC1PIK3CAMTORPIK3CDATR
SCHEMBL28673967 0.78 YTHDC1 (0.37) YTHDC1
SCHEMBL21523565 0.77 YTHDC1 (0.34) YTHDC1ATR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3268373-B1 TRICYCLIC DLK INHIBITORS AND USES THEREOF HOFFMANN LA ROCHE (CH) 2022-04-27 EP disclosed
EP-3268373-B1 TRICYCLIC DLK INHIBITORS AND USES THEREOF HOFFMANN LA ROCHE (CH) 2022-04-27 EP disclosed
CN-107406462-B Tricyclic DLK inhibitors and uses thereof 豪夫迈·罗氏有限公司 2020-11-10 CN disclosed
US-10131675-B2 Tricyclic DLK inhibitors and uses thereof GENENTECH, INC. (US) 2018-11-20 US disclosed
EP-3268373-A1 TRICYCLIC DLK INHIBITORS AND USES THEREOF F. Hoffmann-La Roche AG (CH) 2018-01-17 EP disclosed
US-20170369510-A1 TRICYCLIC DLK INHIBITORS AND USES THEREOF GENENTECH, INC. (US) 2017-12-28 US disclosed
US-20170369510-A1 TRICYCLIC DLK INHIBITORS AND USES THEREOF GENENTECH, INC. (US) 2017-12-28 US disclosed
WO-2016142310-A1 TRICYCLIC DLK INHIBITORS AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2016-09-15 WO disclosed
WO-2016142310-A1 TRICYCLIC DLK INHIBITORS AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2016-09-15 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-10131675-B2 Tricyclic DLK inhibitors and uses thereof NLK, DCLK2, DLK1 YTHDC1 4652/4885PIK3CA 1685/4885MTOR 285/4885
US-20170369510-A1 TRICYCLIC DLK INHIBITORS AND USES THEREOF NLK, DCLK2, DLK1 YTHDC1 4652/4885PIK3CA 1685/4885MTOR 285/4885

“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.