SCHEMBL4878183

SCHEMBL4878183

O=S(=O)(CCN1CCOCC1)c1cccc(Nc2ncccn2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
EPHX2 P34913 3/20 0.55
JAK2 O60674 2/20 0.48
JAK3 P52333 2/20 0.48
ABL1 P00519 2/20 0.48
BCR P11274 1/20 0.48
CDK2 P24941 2/20 0.47
CDK1 P06493 1/20 0.47
MTOR P42345 1/20 0.47
SMG1 Q96Q15 1/20 0.47
CSF1R P07333 1/20 0.46
TYK2 P29597 1/20 0.46
ULK2 Q8IYT8 1/20 0.46
TBK1 Q9UHD2 1/20 0.46
ABL2 P42684 1/20 0.44
SRC P12931 1/20 0.44
ATM Q13315 1/20 0.43
CDK4 P11802 1/20 0.43
SLC6A2 P23975 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
SCHEMBL3454560 0.90 SRC (0.52) MEN1KMT2AEPHX2JAK2JAK3
SCHEMBL3459265 0.89 JAK2 (0.52) MEN1KMT2AEPHX2JAK2JAK3
SCHEMBL2877375 0.86 MEN1 (0.71) MEN1KMT2AEPHX2POLBPKM
SCHEMBL30023094 0.80 KMT2A (0.65) MEN1KMT2AEPHX2JAK2JAK3
SCHEMBL14024420 0.79 JAK3 (0.53) JAK2JAK3CDK2CSF1RTYK2
SCHEMBL14024541 0.77 KDR (0.57) SRCPLK4
SCHEMBL14024626 0.76 KDR (0.49) JAK2JAK3CSF1RTYK2ULK2
SCHEMBL13408045 0.75 MEN1 (0.69) MEN1KMT2AEPHX2KDM4EPOLB
SCHEMBL3459344 0.75 SRC (0.59) EPHX2SRCKDM4EHTT
SCHEMBL3458627 0.74 EPHX2 (0.64) EPHX2KDM4EHTT

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-8349859-B2 Pyrimidine derivatives HUTCHISON MEDIPHARMA ENTERPRISES LIMITED (BS) 2013-01-08 US disclosed
US-20080255172-A1 N4-(2-methyl-1H-indol-5-yl)-N2-phenylpyrimidine-2,4-diamine; angiogenesis related disorder like cancer or age-related macular degeneration HUTCHISON MEDIPHARMA ENTERPRISES LIMETED (BS) 2008-10-16 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 (1 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-20080255172-A1 N4-(2-methyl-1H-indol-5-yl)-N2-phenylpyrimidine-2,4-diamine; angiogenesis related disorder like cancer or age-related macular degeneration CCND2, KDR, FLT4 MEN1 1981/4885KMT2A 1032/4885EPHX2 3455/4885

“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.