SCHEMBL7037634

SCHEMBL7037634

COc1nc(=O)cc(N)[nH]1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 1/20 0.40
HCAR2 Q8TDS4 3/20 0.36
PNP P00491 3/20 0.35
TYMS P04818 2/20 0.33
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
CYP3A4 P08684 1/20 0.32
BLM P54132 1/20 0.32
PDE3B Q13370 2/20 0.32
PDE3A Q14432 2/20 0.32
ABL1 P00519 2/20 0.31
RIN1 Q13671 2/20 0.31
ADORA3 P0DMS8 1/20 0.31
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL1321755 0.76
SCHEMBL14216214 0.72
SCHEMBL6777122 0.72 CYP3A4 (0.55) HCAR2CYP3A4BLM
SCHEMBL18312845 0.68
SCHEMBL10664400 0.68 NUDT1 (0.40) PNPCYP3A4BLMABL1RIN1
SCHEMBL5021587 0.68 L3MBTL1 (0.50) PNPGRIN2CCYP3A4BLMABL1
SCHEMBL5060580 0.68 SMN1; SMN2 (0.41) PNPTYMSGRIN2DGRIN3BGRIN1
SCHEMBL5124123 0.68 PKM (0.41) PNPKDM4ELMNA
SCHEMBL785286 0.65 SMN1; SMN2 (0.48) HCAR2KDM4ELMNAHSD17B10
SCHEMBL15117765 0.64 LMNA (0.44) PNPGRIN2DGRIN3BGRIN1GRIN2A

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-20030114445-A1 N3-substituted 6-anilinopyrimidines and methods to treat-Gram-positive bacterial and mycoplasmal infections NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2003-06-19 US disclosed
WO-2003011297-A1 N3-SUBSTITUTED 6-ANILINOPYRIMIDINES AND METHODS TO TREAT GRAM-POSITIVE BACTERIAL AND MYCOPLASMAL INFECTIONS UNIVERSITY OF MASSACHUSETTS (US) 2003-02-13 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-20030114445-A1 N3-substituted 6-anilinopyrimidines and methods to treat-Gram-positive bacterial and mycoplasmal infections MPHOSPH6, MRPS18A, PNP EHMT2 4127/4885HCAR2 4461/4885PNP 3/4885

“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.