SCHEMBL2385404

SCHEMBL2385404

CC(C)(C)OC(=O)N1CCCN(c2nsnc2Cl)CC1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
LIPA P38571 7/20 0.48
CKS1B P61024 1/20 0.46
SKP1 P63208 1/20 0.46
SKP2 Q13309 1/20 0.46
POLB P06746 1/20 0.44
PDE10A Q9Y233 1/20 0.43
GBA1 P04062 1/20 0.41
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TLR9 Q9NR96 1/20 0.41
SUV39H2 Q9H5I1 1/20 0.40
HPGD P15428 1/20 0.40
KIT P10721 1/20 0.40

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
SCHEMBL2384235 0.95 POLB (0.48) MEN1KMT2ALIPACKS1BSKP1
SCHEMBL5236520 0.81 POLB (0.55) MEN1KMT2ACKS1BSKP1SKP2
SCHEMBL18282608 0.80 SMARCA2 (0.49) LIPACKS1BSKP1SKP2GBA1
SCHEMBL18282671 0.79 KIT (0.46) LIPACKS1BSKP1SKP2GBA1
SCHEMBL18282513 0.79 GBA1 (0.43) LIPACKS1BSKP1SKP2GBA1
SCHEMBL18282583 0.78 KIT (0.43) LIPACKS1BSKP1SKP2GBA1
SCHEMBL18282509 0.77 ALDH1A1 (0.43) MEN1KMT2ALIPACKS1BSKP1
SCHEMBL18282571 0.77 NAMPT (0.43) MEN1KMT2ALIPACKS1BSKP1
SCHEMBL18282618 0.77 GBA1 (0.41) MEN1KMT2ALIPACKS1BSKP1
SCHEMBL15921897 0.76 CKS1B (0.55) MEN1KMT2ACKS1BSKP1SKP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US disclosed
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US disclosed
US-8013156-B2 Tie-2 modulators and methods of use EXELIXIS, INC. (US) 2011-09-06 US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 US disclosed
US-20070275952-A1 Tie-2 Modulators and Methods of Use EXELIXIS, INC. (US) 2007-11-29 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 (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-20070275952-A1 Tie-2 Modulators and Methods of Use TIE1, TEK, KDR MEN1 1132/4885KMT2A 682/4885LIPA 4205/4885

“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.