SCHEMBL16747748

SCHEMBL16747748

CC(C)n1cc(C(N)=O)c2c(N)ncnc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RET P07949 7/20 0.58
LCK P06239 5/20 0.58
SRC P12931 4/20 0.58
PDPK1 O15530 2/20 0.58
ADK P55263 1/20 0.52
KDR P35968 5/20 0.50
TEK Q02763 4/20 0.50
PIK3CD O00329 2/20 0.50
PIK3CA P42336 2/20 0.50
PIK3CB P42338 2/20 0.50
PRKDC P78527 2/20 0.50
PDGFRB P09619 1/20 0.50
PIK3CG P48736 1/20 0.50
PI4KB Q9UBF8 2/20 0.49
ADORA2A P29274 1/20 0.49
ADORA2B P29275 1/20 0.49
ADORA1 P30542 1/20 0.49
PI4KA P42356 1/20 0.49
PI4K2B Q8TCG2 1/20 0.49
PI4K2A Q9BTU6 1/20 0.49

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
SCHEMBL19732639 0.88 RET (0.58) RETLCKSRCPDPK1KDR
SCHEMBL6223045 0.83 PDGFRB (0.57) RETLCKSRCPDPK1KDR
SCHEMBL7700357 0.83 SRC (0.47) RETLCKSRCPDPK1ADK
SCHEMBL1942060 0.82 PDGFRB (0.66) RETLCKSRCPDPK1KDR
SCHEMBL18100426 0.80 ADK (0.55) RETLCKSRCPDPK1ADK
SCHEMBL6220421 0.80 PDGFRB (0.54) RETLCKSRCPDPK1KDR
SCHEMBL4079287 0.79 PDPK1 (0.55) RETLCKSRCPDPK1KDR
SCHEMBL24258000 0.78 PIK3CD (0.51) RETLCKSRCPDPK1KDR
SCHEMBL25750400 0.78 TYK2 (0.40) RETLCKSRCPDPK1KDR
SCHEMBL4090458 0.78 PDPK1 (0.59) RETLCKSRCPDPK1PIK3CD

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-20230201236-A1 SPIROCYCLIC NUCLEOSIDE ANALOGUES FOR THE TREATMENT OF HEPATITIS E Janssen Pharmaceuticals, Inc. 2023-06-29 US disclosed
US-20220033406-A1 CYCLOPENTYL NUCLEOSIDE ANALOGS AS ANTI-VIRALS Janssen Pharmaceuticals, Inc. 2022-02-03 US disclosed
US-20190169221-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Biopharma, Inc. 2019-06-06 US disclosed
US-20160280729-A1 CYCLOPENTANE AND CYCLOPENTENE NUCLEOSIDE ANALOGS FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS LLC (US) 2016-09-29 US disclosed
WO-2015077360-A2 CYCLOPENTANE AND CYCLOPENTENE NUCLEOSIDE ANALOGS FOR THE TREATMENT OF HCV IDENIX PHARMACEUTICALS, INC. (US) 2015-05-28 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 (4 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-20220033406-A1 CYCLOPENTYL NUCLEOSIDE ANALOGS AS ANTI-VIRALS PNP, TYMP, HAVCR2 RET 4850/4885LCK 4397/4885SRC 4752/4885
US-20160280729-A1 CYCLOPENTANE AND CYCLOPENTENE NUCLEOSIDE ANALOGS FOR THE TREATMENT OF HCV ZC3HAV1, HAVCR2, NSUN2 RET 4124/4885LCK 2939/4885SRC 2945/4885
US-20190169221-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C3B RET 2926/4885LCK 3724/4885SRC 4638/4885
US-20230201236-A1 SPIROCYCLIC NUCLEOSIDE ANALOGUES FOR THE TREATMENT OF HEPATITIS E HAVCR2, NME2, SLC10A1 RET 3382/4885LCK 3757/4885SRC 3250/4885

“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.