SCHEMBL5572981

SCHEMBL5572981

O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)(F)F

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.61
GPR35 Q9HC97 1/20 0.58
P2RX1 P51575 7/20 0.56
LMNA P02545 2/20 0.56
ACP1 P24666 1/20 0.54
P2RX4 Q99571 1/20 0.51
P2RX7 Q99572 1/20 0.51
TACR1 P25103 1/20 0.51
IKBKE Q14164 2/20 0.51
IKBKB O14920 2/20 0.51
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51

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
SCHEMBL14015103 0.87 MAPT (0.57) MAPTGPR35P2RX1LMNAACP1
SCHEMBL5108428 0.87 GPR35 (0.50) MAPTGPR35P2RX1LMNAACP1
SCHEMBL23148069 0.84 MAPT (0.62) MAPTGPR35P2RX1LMNAACP1
SCHEMBL26634741 0.84 MAPT (0.58) MAPTGPR35P2RX1LMNAACP1
SCHEMBL2681462 0.83 MAPT (0.78) MAPTGPR35P2RX1LMNAACP1
SCHEMBL7692960 0.83 GPR35 (0.74) MAPTGPR35P2RX1LMNAACP1
SCHEMBL5119432 0.82 NOTUM (0.59) MAPTGPR35P2RX1LMNAMEN1
SCHEMBL2883710 0.81 MAPT (0.68) MAPTP2RX1LMNAMEN1KMT2A
SCHEMBL26639301 0.81 MAPT (0.54) MAPTGPR35P2RX1LMNAACP1
SCHEMBL11788448 0.81 MAPT (0.63) MAPTGPR35P2RX1LMNAACP1

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-20230337677-A1 ARYL AND PYRIDYL AMIDE PESTICIDES AND COMPOSITIONS THEREOF UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2023-10-26 US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 US disclosed
EP-1608373-A2 TIE-2 MODULATORS AND METHODS OF USE Exelixis Inc. (US) 2005-12-28 EP disclosed
WO-2004083235-A2 TIE-2 MODULATORS AND METHODS OF USE EXELIXIS INC. (US) 2004-09-30 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 (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-20070275952-A1 Tie-2 Modulators and Methods of Use TIE1, TEK, KDR MAPT 2716/4885GPR35 2890/4885P2RX1 2045/4885
US-20230337677-A1 ARYL AND PYRIDYL AMIDE PESTICIDES AND COMPOSITIONS THEREOF DDT, ACHE, AHR MAPT 1631/4885GPR35 1183/4885P2RX1 565/4885

“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.