SCHEMBL2238301

SCHEMBL2238301

COc1cncc2[nH]nc(Br)c12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHUK O15111 1/20 0.38
PRKD3 O94806 1/20 0.38
PRKCG P05129 1/20 0.38
PRKCB P05771 1/20 0.38
PRKCA P17252 1/20 0.38
CSNK2A2 P19784 1/20 0.38
PRKCH P24723 1/20 0.38
PRKCI P41743 1/20 0.38
CSNK2B P67870 1/20 0.38
CSNK2A1 P68400 1/20 0.38
PRKCE Q02156 1/20 0.38
PRKCQ Q04759 1/20 0.38
PRKCZ Q05513 1/20 0.38
PRKCD Q05655 1/20 0.38
PRKD1 Q15139 1/20 0.38
AXL P30530 1/20 0.37
BTK Q06187 1/20 0.32
BRD4 O60885 1/20 0.31
MKNK1 Q9BUB5 1/20 0.31
CLK1 P49759 2/20 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
SCHEMBL30548031 0.75 HTR2A (0.50)
SCHEMBL16981773 0.72
SCHEMBL249744 0.71 PDPK1 (0.47) PRKD3
SCHEMBL23122126 0.70 CYP1A2 (0.33)
SCHEMBL12970633 0.70 CHUK (0.37) CHUKPRKD3PRKCGPRKCBPRKCA
SCHEMBL3581254 0.67 ALDH1A1 (0.39) CHUKPRKD3PRKCGPRKCBPRKCA
SCHEMBL1846517 0.66 LRRK2 (0.46) DYRK1ADYRK1B
SCHEMBL14786531 0.64 BRD4 (0.34) CHUKPRKD3PRKCGPRKCBPRKCA
SCHEMBL30702001 0.64 ADORA2A (0.34) BTK
SCHEMBL13950884 0.63 JAK2 (0.36) CSNK2A1AXL

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-20110201599-A1 CDK Modulators EXELIXIS, INC. (US) 2011-08-18 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-20110201599-A1 CDK Modulators CDK3, CDK1, CDKL1 CHUK 163/4885PRKD3 81/4885PRKCG 634/4885

“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.