SCHEMBL4573357

SCHEMBL4573357

CS(=O)(=O)N(CCO)c1c[c]ccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.33
KMT2A Q03164 4/20 0.33
MEN1 O00255 2/20 0.33
LMNA P02545 4/20 0.33
GRIN1 Q05586 3/20 0.33
TSHR P16473 2/20 0.33
PER2 O15055 1/20 0.33
MAPK1 P28482 1/20 0.33
CRY1 Q16526 1/20 0.33
CRY2 Q49AN0 1/20 0.33
KDM4E B2RXH2 1/20 0.32
HTT P42858 1/20 0.32
AURKA O14965 1/20 0.32
CDK1 P06493 1/20 0.32
CCNB1 P14635 1/20 0.32
MMP2 P08253 1/20 0.32
MMP9 P14780 1/20 0.32
POLB P06746 1/20 0.31
RECQL P46063 1/20 0.31

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
SCHEMBL687367 0.85 ESR1 (0.37) RORCSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL1355116 0.80 MMP2 (0.37) RORCSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL27754450 0.80 SMN1; SMN2 (0.47) RORCSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL7245951 0.77 ALDH1A1 (0.49) SMN1; SMN2KMT2AMEN1LMNATSHR
SCHEMBL346581 0.74 MAPT (0.35) SMN1; SMN2KMT2AMEN1LMNAKDM4E
SCHEMBL183537 0.74 NR3C2 (0.30)
SCHEMBL10494098 0.74 ESR1 (0.40) RORCSMN1; SMN2KMT2AMEN1LMNA
SCHEMBL687171 0.73 ALDH1A1 (0.40) SMN1; SMN2KMT2AMEN1LMNAMAPK1
SCHEMBL2536415 0.72 ESR1 (0.37) RORCSMN1; SMN2KMT2ALMNATSHR
SCHEMBL14949883 0.72 ALDH1A1 (0.37) SMN1; SMN2KMT2AMEN1TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8729089-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-05-20 US claimed
US-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-31 US claimed
WO-2008077651-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-03 WO claimed
US-8729089-B2 Pyrido(3,2-d)pyrimidines useful for treating viral infections GILEAD SCIENCES, INC. (US) 2014-05-20 US disclosed
US-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-31 US disclosed
WO-2008077651-A1 PYRIDO(3,2-D)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-07-03 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 (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-20080182870-A1 PYRIDO(3,2-d)PYRIMIDINES USEFUL FOR TREATING VIRAL INFECTIONS PNPO, DPYD, PNP RORC 353/4885SMN1; SMN2 2183/4885KMT2A 4285/4885

“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.