SCHEMBL521185

SCHEMBL521185

CSc1nc(Cl)c2cccn2n1.CSc1nn2cccc2c(=O)[nH]1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SPR P35270 13/20 0.36
GFER P55789 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
ALDH1A1 P00352 1/20 0.33
LMNA P02545 2/20 0.32
XDH P47989 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL519783 0.85 SPR (0.44) SPRLMNAXDH
SCHEMBL520151 0.84 TGFBR1 (0.39) ALDH1A1LMNAPOLB
SCHEMBL2508645 0.73 RPS6KA5 (0.38) ALDH1A1
SCHEMBL18689758 0.70 SPR (0.47) SPR
SCHEMBL28378560 0.67 TGFBR1 (0.39) ALDH1A1LMNAPOLB
SCHEMBL12102104 0.66 SPR (0.50) SPR
SCHEMBL29943781 0.66 MEN1 (0.42) SPRLMNA
SCHEMBL18701500 0.66 SPR (0.44) SPRALDH1A1
SCHEMBL519991 0.65 POLB (0.40) GFERRXFP1ALDH1A1LMNAXDH
SCHEMBL10292423 0.64 PTPN1 (0.38) ALDH1A1

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-20120028919-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS CEPHALON, INC. (US) 2012-02-02 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-20120028919-A1 PYRROLOTRIAZINES AS ALK AND JAK2 INHIBITORS JAK2, ALK, ABL1 SPR 3444/4885GFER 4090/4885RXFP1 3059/4885

“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.