SCHEMBL12551843

SCHEMBL12551843

CC(C)(CO)Cn1nc(Cc2ccccc2Cl)c2c(N)ncnc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKD3 O94806 2/20 0.52
▸ PRKD1 Q15139 2/20 0.52
▸ PRKD2 Q9BZL6 2/20 0.52
▸ SRC P12931 12/20 0.48
▸ ABL1 P00519 4/20 0.48
▸ RIPK2 O43353 1/20 0.48
▸ FYN P06241 1/20 0.48
▸ PRKACA P17612 1/20 0.48
▸ CDK2 P24941 1/20 0.48
▸ CSK P41240 1/20 0.48
▸ MAPK8 P45983 1/20 0.48
▸ CSNK1A1 P48729 1/20 0.48
▸ CSNK1E P49674 1/20 0.48
▸ MAPK14 Q16539 1/20 0.48
▸ CDK12 Q9NYV4 1/20 0.48
▸ CAMK2A Q9UQM7 1/20 0.48
▸ CYP1A2 P05177 2/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44

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
SCHEMBL12551813 0.89 CYP1A2 (0.56) PRKD3PRKD1PRKD2SRCABL1
SCHEMBL12551850 0.83 SRC (0.51) PRKD3PRKD1PRKD2SRCABL1
SCHEMBL12551828 0.81 SRC (0.52) PRKD3PRKD1PRKD2SRCABL1
SCHEMBL12551815 0.81 SRC (0.45) PRKD3PRKD1PRKD2SRCABL1
SCHEMBL1962448 0.80 SRC (0.72) PRKD3PRKD1PRKD2SRCABL1
SCHEMBL12551836 0.80 SRC (0.50) PRKD3PRKD1PRKD2SRCABL1
SCHEMBL12551829 0.79 SRC (0.49) PRKD3PRKD1PRKD2SRCABL1
SCHEMBL12551801 0.79 SRC (0.51) PRKD3PRKD1PRKD2SRCABL1
SCHEMBL12551848 0.78 SRC (0.46) PRKD3PRKD1PRKD2SRCABL1
SCHEMBL12551831 0.78 SRC (0.49) PRKD3PRKD1PRKD2SRCABL1

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-9512125-B2 Substituted pyrazolo[3.4-D] pyrimidines as anti-inflammatory agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-12-06 — — US disclosed
US-9512125-B2 Substituted pyrazolo[3.4-D] pyrimidines as anti-inflammatory agents THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-12-06 — — US disclosed
US-20110144134-A1 Anti-Inflammatory Pyrazolopyrimndines THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-06-16 — — US disclosed
US-20110144134-A1 Anti-Inflammatory Pyrazolopyrimndines THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-06-16 — — US disclosed
US-20090124638-A1 ANTI-INFLAMMATORY PYRAZOLOPYRIMIDINES REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-05-14 — — US disclosed
US-20090124638-A1 ANTI-INFLAMMATORY PYRAZOLOPYRIMIDINES REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-05-14 — — 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-20110144134-A1 Anti-Inflammatory Pyrazolopyrimndines TSLP, NLRP3, IL1B PRKD3 938/4885PRKD1 1806/4885PRKD2 1198/4885
US-20090124638-A1 ANTI-INFLAMMATORY PYRAZOLOPYRIMIDINES TNF, TSLP, IL1B PRKD3 1969/4885PRKD1 2453/4885PRKD2 1986/4885

“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.

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