SCHEMBL3349201

SCHEMBL3349201

CC(C)(C)OC(=O)NC1CCC(c2c[nH]c3ncccc23)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
JAK1 P23458 5/20 0.53
JAK2 O60674 2/20 0.53
TYK2 P29597 1/20 0.53
JAK3 P52333 1/20 0.53
HSD11B1 P28845 5/20 0.50
BTK Q06187 3/20 0.46
OPRL1 P41146 2/20 0.45
OPRM1 P35372 1/20 0.45
OPRK1 P41145 1/20 0.45
RET P07949 1/20 0.45
KDR P35968 1/20 0.45
AXL P30530 1/20 0.44
KDM1A O60341 1/20 0.43
MAOB P27338 1/20 0.43
EPHX2 P34913 1/20 0.43

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
SCHEMBL20111682 0.84 HSD11B1 (0.49) JAK1JAK2TYK2JAK3HSD11B1
SCHEMBL21714322 0.84 HSD11B1 (0.49) JAK1JAK2TYK2JAK3HSD11B1
SCHEMBL20111683 0.84 HSD11B1 (0.49) JAK1JAK2TYK2JAK3HSD11B1
SCHEMBL21714263 0.84 HSD11B1 (0.49) JAK1JAK2TYK2JAK3HSD11B1
SCHEMBL12326969 0.82 JAK1 (0.48) JAK1JAK2TYK2JAK3HSD11B1
SCHEMBL2267177 0.80 HSD11B1 (0.63) JAK1JAK2TYK2JAK3HSD11B1
SCHEMBL5750470 0.79 HSD11B1 (0.56) HSD11B1OPRL1OPRM1OPRK1AXL
SCHEMBL20792300 0.78 HSD11B1 (0.49) JAK1JAK2TYK2JAK3HSD11B1
SCHEMBL20775412 0.78 HSD11B1 (0.49) JAK1JAK2TYK2JAK3HSD11B1
SCHEMBL16719380 0.78 OPRL1 (0.64) HSD11B1OPRL1OPRM1OPRK1AXL

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
US-20180370966-A1 METHODS OF TREATMENT USING PYRIDINONYL PDK1 INHIBITORS SUNESIS PHARMACEUTICALS, INC. 2018-12-27 US disclosed
US-9873693-B2 Methods of treatment using pyridinonyl PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2018-01-23 US disclosed
US-8778977-B2 Pyridinonyl PDK1 inhibitors SUNESIS PHARMACEUTICALS, INC. (US) 2014-07-15 US disclosed
EP-2038272-B1 PYRIDINONYL PDK1 INHIBITORS SUNESIS PHARMACEUTICALS INC (US) 2013-09-04 EP disclosed
US-20100144730-A1 PYRIDINONYL PDK1 INHIBITORS SUNESIS PHAMACEUTICALS (US) 2010-06-10 US disclosed
EP-2038272-A2 PYRIDINONYL PDK1 INHIBITORS Sunesis Pharmaceuticals, Inc. (US) 2009-03-25 EP disclosed
WO-2008005457-A2 PYRIDINONYL PDK1 INHIBITORS SUNESIS PHARMACEUTICALS (US) 2008-01-10 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-20180370966-A1 METHODS OF TREATMENT USING PYRIDINONYL PDK1 INHIBITORS PDK1, PDK2, PDK3 JAK1 2615/4885JAK2 1237/4885TYK2 1832/4885
US-20100144730-A1 PYRIDINONYL PDK1 INHIBITORS PDK1, PDK2, PDK3 JAK1 2566/4885JAK2 1412/4885TYK2 1568/4885

“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.