SCHEMBL5361502

SCHEMBL5361502

O=C1Nc2ccc(OCC(O)CO)cc2C1=Cc1ccc[nH]1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 8/20 0.64
TLK2 Q86UE8 4/20 0.64
NTRK1 P04629 1/20 0.64
PDGFRB P09619 2/20 0.58
PDGFRA P16234 1/20 0.58
FLT1 P17948 1/20 0.58
KDR P35968 1/20 0.58
PAK4 O96013 7/20 0.56
RET P07949 2/20 0.56
FLT3 P36888 1/20 0.56
ALK Q9UM73 1/20 0.56
JAK3 P52333 1/20 0.55
CDK1 P06493 1/20 0.54
CCNB1 P14635 1/20 0.54
NEK2 P51955 1/20 0.54

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
SCHEMBL8588052 0.82 MAP4K1 (0.44) PDPK1TLK2NTRK1PDGFRBPDGFRA
SCHEMBL8588039 0.82 MAP4K1 (0.44) PDPK1TLK2NTRK1PDGFRBPDGFRA
SCHEMBL8529701 0.80 KDM4E (0.47) NTRK1PDGFRBKDRRETFLT3
SCHEMBL5369374 0.80 TLK2 (0.71) PDPK1TLK2NTRK1PDGFRBPDGFRA
SCHEMBL8586259 0.79 NTRK1 (0.57) PDPK1NTRK1PDGFRBPDGFRAKDR
SCHEMBL8586257 0.79 NTRK1 (0.57) PDPK1NTRK1PDGFRBPDGFRAKDR
SCHEMBL5367043 0.79 NTRK1 (0.66) PDPK1TLK2NTRK1JAK3CDK1
SCHEMBL5728024 0.79 TLK2 (1.00) PDPK1TLK2NTRK1PDGFRBPDGFRA
SCHEMBL5728025 0.79 TLK2 (1.00) PDPK1TLK2NTRK1PDGFRBPDGFRA
SCHEMBL5364426 0.78 RET (0.67) PDPK1TLK2NTRK1PDGFRBPDGFRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US disclosed
US-20050197382-A1 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. 2005-09-08 US disclosed
EP-1247803-A2 Indolinone compounds suitable for modulation of protein kinases Sugen, Inc. (US) 2002-10-09 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-20050197382-A1 Indolinone combinatorial libraries and related products and methods for the treatment of disease FRK, PTK2, DSTYK PDPK1 31/4885TLK2 48/4885NTRK1 223/4885

“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.