SCHEMBL5266014

SCHEMBL5266014

COC(=O)c1cc(-c2ccc(C#N)cn2)n(-c2ccc(Cl)nn2)n1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGLN2 Q96KS0 3/20 0.39
P2RX7 Q99572 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM5A P29375 1/20 0.36
KDM5B Q9UGL1 1/20 0.36
CYP11B2 P19099 2/20 0.35
SMO Q99835 1/20 0.35
RPA1 P27694 1/20 0.35
CYP11B1 P15538 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HSP90AA1 P07900 1/20 0.34
HSP90B1 P14625 1/20 0.34
PANK3 Q9H999 2/20 0.33
ALOX5 P09917 1/20 0.33

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
SCHEMBL5268935 0.89 EGLN2 (0.39) EGLN2P2RX7KDM5AKDM5BCYP11B2
SCHEMBL5522528 0.87 ALOX5 (0.40) SMN1; SMN2RPA1MEN1KMT2AALOX5
SCHEMBL5527972 0.85 ALOX5 (0.37) SMN1; SMN2KDM5AKDM5BMEN1KMT2A
SCHEMBL5269426 0.82 SMN1; SMN2 (0.38) SMN1; SMN2MEN1KMT2AALOX5
SCHEMBL2917351 0.81 SLC16A3 (0.40) SMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL5266028 0.81 RAB9A (0.39) SMN1; SMN2MEN1KMT2AALOX5
SCHEMBL5271831 0.80 RPA1 (0.43) KDM5AKDM5BRPA1L3MBTL1
SCHEMBL5524845 0.79 MDM2 (0.43) SMN1; SMN2RPA1MEN1KMT2AALOX5
SCHEMBL5268843 0.79 SMN1; SMN2 (0.38) P2RX7SMN1; SMN2MEN1KMT2AALOX5
SCHEMBL4933068 0.77 CA9 (0.42) SMN1; SMN2KMT2AALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070254881-A1 Pyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-11-01 US disclosed
US-20070219210-A1 Amidopyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-09-20 US disclosed
CN-101001852-A Pyrazole derivatives DAIICHI SEIYAKU CO (JP) 2007-07-18 CN disclosed
EP-1785418-A1 PYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-05-16 EP 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-20070254881-A1 Pyrazole Derivative PTGER1, PTGS1, PTGER2 EGLN2 547/4885P2RX7 126/4885SMN1; SMN2 3490/4885
US-20070219210-A1 Amidopyrazole Derivative PTGER1, PTGS1, PTGER2 EGLN2 75/4885P2RX7 446/4885SMN1; SMN2 4048/4885

“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.