SCHEMBL4932725

SCHEMBL4932725

O=C(O)c1cc(-c2ccc(Cl)cn2)n(-c2cccnc2)n1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MARS1 P56192 5/20 0.64
L3MBTL1 Q9Y468 1/20 0.54
PPP1CA P62136 3/20 0.52
RPA1 P27694 6/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
ATM Q13315 1/20 0.46

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
SCHEMBL4927577 0.87 MARS1 (0.53) MARS1L3MBTL1PPP1CARPA1SMN1; SMN2
SCHEMBL4932097 0.86 MARS1 (0.53) MARS1L3MBTL1PPP1CARPA1SMN1; SMN2
SCHEMBL5524370 0.86 MARS1 (0.53) MARS1L3MBTL1PPP1CARPA1MEN1
SCHEMBL27648672 0.86 MARS1 (0.53) MARS1L3MBTL1PPP1CARPA1SMN1; SMN2
SCHEMBL27668835 0.84 MARS1 (0.55) MARS1L3MBTL1PPP1CARPA1SMN1; SMN2
SCHEMBL4927582 0.84 MARS1 (0.51) MARS1L3MBTL1PPP1CARPA1SMN1; SMN2
SCHEMBL5529104 0.84 CNR1 (0.51) MARS1L3MBTL1SMN1; SMN2MEN1KMT2A
SCHEMBL4927109 0.84 KMT2A (0.52) MARS1MEN1KMT2A
SCHEMBL4933051 0.82 MGLL (0.51) MARS1SMN1; SMN2MEN1KMT2A
SCHEMBL5530134 0.82 CNR1 (0.50) MARS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080064682-A1 Pyrazole Derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-03-13 US disclosed
US-20080064682-A1 Pyrazole Derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-03-13 US disclosed
US-20080064682-A1 Pyrazole Derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-03-13 US disclosed
US-20070219210-A1 Amidopyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-09-20 US disclosed
US-20070219210-A1 Amidopyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-09-20 US disclosed
US-20070219210-A1 Amidopyrazole Derivative DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-09-20 US disclosed
CN-1980912-A Pyrazole derivatives DAIICHI SEIYAKU CO (JP) 2007-06-13 CN disclosed
EP-1762568-A1 PYRAZOLE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-03-14 EP disclosed
EP-1762568-A1 PYRAZOLE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-03-14 EP disclosed
CN-1902191-A Amidopyrazole derivative DAIICHI SEIYAKU CO (JP) 2007-01-24 CN disclosed
EP-1698626-A1 AMIDOPYRAZOLE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-09-06 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-20080064682-A1 Pyrazole Derivatives NAT1, AR, CBR3 MARS1 760/4885L3MBTL1 3613/4885PPP1CA 3996/4885
US-20070219210-A1 Amidopyrazole Derivative PTGER1, PTGS1, PTGER2 MARS1 2982/4885L3MBTL1 3071/4885PPP1CA 4697/4885

“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.