SCHEMBL4101731

SCHEMBL4101731

Fc1ccc(-c2ccc3nc(CCl)nc(N4CCN(C(=S)NCc5ccccc5Cl)CC4)c3n2)cc1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 4/20 0.45
PDGFRA P16234 1/20 0.45
MAPT P10636 4/20 0.39
KDM4E B2RXH2 1/20 0.39
KMT2A Q03164 5/20 0.38
MEN1 O00255 4/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
LMNA P02545 1/20 0.38
ALDH1A1 P00352 3/20 0.37
PKM P14618 1/20 0.37
NR2F2 P24468 1/20 0.37
POLB P06746 1/20 0.37
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL4107869 0.93 KMT2A (0.38) PDGFRBPDGFRAMAPTKDM4EKMT2A
SCHEMBL4119502 0.91 KMT2A (0.41) PDGFRBPDGFRAMAPTKDM4EKMT2A
SCHEMBL4114292 0.90 TP53 (0.42) MAPTTP53PKM
SCHEMBL4118440 0.90 PDGFRB (0.47) PDGFRBPDGFRAMAPTKDM4EKMT2A
SCHEMBL4107542 0.89 PDGFRB (0.46) PDGFRBPDGFRAMAPTKDM4EKMT2A
SCHEMBL4102701 0.88 ALDH1A1 (0.43) PDGFRBPDGFRAMAPTKDM4EKMT2A
SCHEMBL4108083 0.87 MEN1 (0.44) PDGFRBPDGFRAMAPTKDM4EKMT2A
SCHEMBL4114415 0.86 PDGFRB (0.47) PDGFRBPDGFRAMAPTKDM4EKMT2A
SCHEMBL4102258 0.86 PDGFRB (0.41) PDGFRBPDGFRAMAPTKDM4EKMT2A
SCHEMBL4121626 0.85 KMT2A (0.44) MAPTKDM4EKMT2AMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264415-A2 PYRIDO(3,2-D)PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR MEDICAL TREATMENT 4 AZA IP NV (BE) 2009-10-22 US disclosed
US-20090036430-A1 PYRIDO(3,2-D)PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR MEDICAL TREATMENT 4 AZA IP NV (BE) 2009-02-05 US disclosed
US-20080004285-A1 PYRIDO(3,2-D)PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR MEDICAL TREATMENT 4 AZA IP NV (BE) 2008-01-03 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 (3 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-20080004285-A1 PYRIDO(3,2-D)PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR MEDICAL TREATMENT PNPO, TYMP, PNP PDGFRB 199/4885PDGFRA 292/4885MAPT 1541/4885
US-20090036430-A1 PYRIDO(3,2-D)PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR MEDICAL TREATMENT PNPO, TYMP, PNP PDGFRB 199/4885PDGFRA 292/4885MAPT 1541/4885
US-20090264415-A2 PYRIDO(3,2-D)PYRIMIDINES AND PHARMACEUTICAL COMPOSITIONS USEFUL FOR MEDICAL TREATMENT PNPO, TYMP, PNP PDGFRB 199/4885PDGFRA 292/4885MAPT 1541/4885

“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.