SCHEMBL13932142

SCHEMBL13932142

CCC(NC(=O)NC)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RRM1 P23921 2/20 0.33
RRM2 P31350 2/20 0.33
RRM2B Q7LG56 2/20 0.33
PRSS1 P07477 1/20 0.33
CTSG P08311 1/20 0.33
CTRB1 P17538 1/20 0.33
CMA1 P23946 1/20 0.33
TSHR P16473 2/20 0.32
USP2 O75604 1/20 0.32
CTSK P43235 1/20 0.31
MMP2 P08253 5/20 0.31
MMP3 P08254 5/20 0.31
MMP1 P03956 3/20 0.31
MMP7 P09237 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL27439171 0.80 CTSK (0.43) PRSS1CTSGCTRB1CMA1CTSK
SCHEMBL13686139 0.78 ADAM17 (0.31)
SCHEMBL14376297 0.77 KDM4E (0.35) RRM1RRM2RRM2BPRSS1CTSG
SCHEMBL12086289 0.77 KDM4E (0.35) RRM1RRM2RRM2BPRSS1CTSG
SCHEMBL13686207 0.76 ALDH1A1 (0.32)
SCHEMBL5207103 0.76 TSHR (0.33) RRM1RRM2RRM2BPRSS1CTSG
SCHEMBL10066634 0.76 CYP2C9 (0.45) RRM1RRM2RRM2BPRSS1CTSG
SCHEMBL25583790 0.76 CYP2C9 (0.45) RRM1RRM2RRM2BPRSS1CTSG
SCHEMBL12404657 0.76 CNR2 (0.39) RRM1RRM2RRM2BPRSS1CTSG
SCHEMBL5204828 0.75 PRSS1 (0.31) PRSS1CTSGCTRB1CMA1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090082369-A1 Pyrrolo[2,3d]pyrimidine compositions and their use OSI PHARMACEUTICALS, INC. 2009-03-26 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-20090082369-A1 Pyrrolo[2,3d]pyrimidine compositions and their use ADORA3, ADORA2A, ADORA1 RRM1 181/4885RRM2 72/4885RRM2B 82/4885

“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.