SCHEMBL1115902

SCHEMBL1115902

COc1cc(C(=O)O)c2[nH]c(Nc3cccc(Cl)c3Cl)nc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 1/20 0.45
FABP4 P15090 1/20 0.45
MAPT P10636 3/20 0.44
DYRK1A Q13627 3/20 0.42
CDK9 P50750 2/20 0.42
DYRK2 Q92630 1/20 0.42
DYRK1B Q9Y463 1/20 0.42
CSF1R P07333 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
LMNA P02545 2/20 0.42
HPGD P15428 1/20 0.42
GFER P55789 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
AKR1C3 P42330 2/20 0.41
AKR1C2 P52895 2/20 0.41
RORC P51449 4/20 0.40
CDC25B P30305 1/20 0.39
HDAC11 Q96DB2 1/20 0.39
POLB P06746 1/20 0.38

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
SCHEMBL1115898 0.92 MAPT (0.44) FABP3FABP4MAPTDYRK1ACDK9
SCHEMBL1116255 0.86 MAPT (0.46) FABP3FABP4MAPTDYRK1AMEN1
SCHEMBL2926922 0.84 MAPT (0.44) FABP3FABP4MAPTCSF1RMEN1
SCHEMBL12856631 0.84 MAPT (0.44) FABP3FABP4MAPTCSF1RMEN1
SCHEMBL12856619 0.84 MAPT (0.44) FABP3FABP4MAPTCSF1RMEN1
SCHEMBL1116024 0.84 MAPT (0.44) FABP3FABP4MAPTCSF1RMEN1
SCHEMBL12856603 0.82 MAPT (0.46) FABP3FABP4MAPTDYRK1ACDK9
SCHEMBL1116205 0.81 MAPT (0.42) FABP3FABP4MAPTMEN1KMT2A
SCHEMBL1116014 0.81 MAPT (0.46) MAPTCSF1RMEN1KMT2A
SCHEMBL1115894 0.79 MAPT (0.44) MAPTCSF1RMEN1KMT2AHDAC11

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
EP-2281819-A1 Benzimidazolyl or benzoxazolyl derivatives Novartis AG (CH) 2011-02-09 EP disclosed
EP-2281819-A1 Benzimidazolyl or benzoxazolyl derivatives Novartis AG (CH) 2011-02-09 EP disclosed
US-20090298824-A1 Organic compounds PRESS NEIL J 2009-12-03 US disclosed
US-20090298824-A1 Organic compounds PRESS NEIL J 2009-12-03 US disclosed
US-20090298824-A1 Organic compounds PRESS NEIL J 2009-12-03 US disclosed
EP-1709015-A1 ORGANIC COMPOUNDS Novartis AG (CH) 2006-10-11 EP disclosed
WO-2005070906-A1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2005-08-04 WO 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-20090298824-A1 Organic compounds CXCR2, CXCR3, CXCR1 FABP3 1991/4885FABP4 1356/4885MAPT 4012/4885

“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.