SCHEMBL19686248

SCHEMBL19686248

CCCCOc1nc(N)nc(C)c1C

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 4/20 0.53
CCNB1 P14635 4/20 0.53
CCNA2 P20248 3/20 0.53
CDK2 P24941 3/20 0.53
CCNA1 P78396 3/20 0.53
PIN1 Q13526 1/20 0.53
TLR8 Q9NR97 10/20 0.47
TLR7 Q9NYK1 4/20 0.47
DHFR P00374 2/20 0.39
NOS1 P29475 1/20 0.38
MAPK8 P45983 1/20 0.37
MAPK9 P45984 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
HSD17B10 Q99714 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA9 Q16790 1/20 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
SCHEMBL23114953 0.89 CDK1 (0.49) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL29308078 0.86 CDK1 (0.53) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL20421683 0.83 TLR8 (0.50) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL23114952 0.81 MAPK1 (0.41) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL12352016 0.79 DHFR (0.49) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL11699945 0.76 CDK1 (0.54) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL8080229 0.74 CDK1 (0.51) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL20783723 0.73 MPO (0.47) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL18049854 0.73 NUDT1 (0.57) CDK1CCNB1CCNA2CDK2CCNA1
SCHEMBL19146160 0.73 CDK1 (0.36) CDK1CCNB1CCNA2CDK2CCNA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210077634-A1 IN VIVO PRODUCTION OF PROTEINS MODERNATX INC (US) 2021-03-18 US disclosed
US-20170348436-A1 IN VIVO PRODUCTION OF PROTEINS ARES CAPITAL CORPORATION, AS AGENT 2017-12-07 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-20210077634-A1 IN VIVO PRODUCTION OF PROTEINS NSUN2, RNMT, NSUN3 CDK1 1680/4885CCNB1 2416/4885CCNA2 1600/4885
US-20170348436-A1 IN VIVO PRODUCTION OF PROTEINS MSH2, POLRMT, POLN CDK1 3360/4885CCNB1 2615/4885CCNA2 1226/4885

“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.