SCHEMBL4873369

SCHEMBL4873369

Cc1[nH]c2c(=O)n([C@@H]3CCNC[C@@H]3F)ccc2c1Cl

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 4/20 0.34
JAK1 P23458 4/20 0.34
SSTR1 P30872 1/20 0.31
SSTR4 P31391 1/20 0.31
BPTF Q12830 2/20 0.31
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
KCNH2 Q12809 1/20 0.30
TLR9 Q9NR96 1/20 0.30
TLR8 Q9NR97 1/20 0.30
TLR7 Q9NYK1 1/20 0.30
HSP90AB1 P08238 1/20 0.30
TOP2A P11388 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
SCHEMBL4873377 1.00 JAK2 (0.34) JAK2JAK1SSTR1SSTR4BPTF
SCHEMBL4764601 0.82 TP53 (0.33) HTR2AHTR2CHSP90AB1TOP2A
SCHEMBL4764579 0.70 DRD2 (0.34) HTR2A
SCHEMBL4766195 0.68 DRD2 (0.52)
SCHEMBL15011795 0.66 JAK2 (0.39) JAK2JAK1SSTR4HTR2AHTR2C
SCHEMBL20689435 0.64 SLC6A2 (0.42) SSTR1SSTR4HTR2AHTR2CKCNH2
SCHEMBL20689429 0.64 SLC6A2 (0.42) SSTR1SSTR4HTR2AHTR2CKCNH2
SCHEMBL26116816 0.63 DDB1 (0.33) JAK2JAK1
SCHEMBL26117731 0.63 DDB1 (0.33) JAK2JAK1
SCHEMBL26116146 0.63 DDB1 (0.33) JAK2JAK1

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-20080312211-A1 Antibacterial Pyrrolopyridines, Pyrrolopyrimidines and Pyrroloazepines-154 ASTRAZENECA AB (SE) 2008-12-18 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-20080312211-A1 Antibacterial Pyrrolopyridines, Pyrrolopyrimidines and Pyrroloazepines-154 SDHA, QDPR, PNKP JAK2 3083/4885JAK1 3063/4885SSTR1 3514/4885

“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.