SCHEMBL2416181

SCHEMBL2416181

O=C(Cc1ccccc1F)Nc1n[nH]c2sc(C(=O)Nc3ccc(N4CCOCC4)cc3)cc12

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 2/20 0.49
KDM4E B2RXH2 1/20 0.49
AURKA O14965 1/20 0.45
PDE7A Q13946 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 3/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
CHRNA7 P36544 1/20 0.43
ROCK1 Q13464 1/20 0.42
DGAT1 O75907 1/20 0.42
POLB P06746 1/20 0.42
STAT6 P42226 1/20 0.42
HTT P42858 1/20 0.41

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
SCHEMBL2415752 0.91 AURKA (0.51) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2415218 0.90 MAPT (0.49) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2982436 0.88 SMN1; SMN2 (0.59) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2415661 0.87 MAPT (0.49) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2417753 0.84 AURKA (0.60) AURKAROCK1
SCHEMBL2418883 0.84 PDE7A (0.49) MAPTMEN1KMT2AALDH1A1KDM4E
SCHEMBL2415167 0.84 MAPT (0.50) MAPTKMT2AALDH1A1AURKAPDE7A
SCHEMBL2418630 0.82 MAPT (0.52) MAPTMEN1KMT2AALDH1A1AURKA
SCHEMBL2416736 0.82 AURKA (0.52) MAPTKMT2AALDH1A1KDM4EAURKA
SCHEMBL2418683 0.82 MAPT (0.55) MAPTMEN1KMT2AALDH1A1PDE7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7541378-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2009-06-02 US claimed
EP-1530573-B1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PFIZER ITALIA SRL (IT) 2008-03-19 EP claimed
US-8017643-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2011-09-13 US disclosed
US-20100286223-A1 Condensed Heterocyclic Pyrazole Derivatives as Kinase Inhibitors PFIZER ITALIA S.R.L. (IT) 2010-11-11 US disclosed
US-7786048-B2 Condensed heterocyclic pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2010-08-31 US disclosed
US-20090233813-A1 Condensed Heterocyclic Pyrazole Derivatives as Kinase Inhibitors PFIZER ITALIA S.R.L. (IT) 2009-09-17 US disclosed
EP-1530573-B1 CONDENSED HETEROCYCLIC PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PFIZER ITALIA SRL (IT) 2008-03-19 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 (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-20100286223-A1 Condensed Heterocyclic Pyrazole Derivatives as Kinase Inhibitors CDK2, MAP3K19, MAP3K15 MAPT 2293/4885MEN1 2694/4885KMT2A 1298/4885

“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.