SCHEMBL5369945

SCHEMBL5369945

Cc1ccc(C=C2C(=O)Nc3ccc(NCC(O)CO)cc32)s1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 7/20 0.43
PDPK1 O15530 2/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
HPGD P15428 1/20 0.42
RECQL P46063 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PAK4 O96013 1/20 0.41
EGFR P00533 1/20 0.40
GSK3B P49841 4/20 0.40
TLK2 Q86UE8 3/20 0.39

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
SCHEMBL5376663 0.81 NTRK1 (0.43) NTRK1PDPK1ALDH1A1MAPTKMT2A
SCHEMBL5358502 0.80 LRRK2 (0.42) NTRK1PDPK1ALDH1A1MAPTTHRB
SCHEMBL7493570 0.80 NTRK1 (0.64) NTRK1PDPK1MAPTRECQLKMT2A
SCHEMBL5358704 0.78 AKT2 (0.60) PDPK1GSK3B
SCHEMBL5367043 0.78 NTRK1 (0.66) NTRK1PDPK1TLK2
SCHEMBL5359077 0.77 EGFR (0.47) PDPK1ALDH1A1MAPTTHRBHPGD
SCHEMBL5364317 0.77 AKT2 (0.48) PDPK1GSK3BTLK2
SCHEMBL5367370 0.77 PDPK1 (0.69) NTRK1PDPK1ALDH1A1MAPTTHRB
SCHEMBL8530225 0.76 MAPT (0.46) NTRK1ALDH1A1MAPTGSK3B
SCHEMBL6001533 0.76 LRRK2 (0.58) EGFR

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 NTRK1 223/4885PDPK1 31/4885ALDH1A1 2044/4885

“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.