SCHEMBL5357950

SCHEMBL5357950

Cc1ccc(C=C2C(=O)Nc3ccc(NC(=O)CCC4CCCNC4)cc32)s1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PAK1 Q13153 14/20 0.46
▸ TLK2 Q86UE8 1/20 0.45
▸ HDAC3 O15379 3/20 0.44
▸ HDAC4 P56524 3/20 0.44
▸ HDAC1 Q13547 3/20 0.44
▸ HDAC7 Q8WUI4 3/20 0.44
▸ HDAC2 Q92769 3/20 0.44
▸ HDAC10 Q969S8 3/20 0.44
▸ HDAC11 Q96DB2 3/20 0.44
▸ HDAC8 Q9BY41 3/20 0.44
▸ HDAC6 Q9UBN7 3/20 0.44
▸ HDAC9 Q9UKV0 3/20 0.44
▸ HDAC5 Q9UQL6 3/20 0.44
▸ ROCK2 O75116 1/20 0.44
▸ PDGFRB P09619 2/20 0.42
▸ FLT1 P17948 2/20 0.42
▸ KDR P35968 2/20 0.42
▸ PDGFRA P16234 1/20 0.42
▸ MAPK1 P28482 1/20 0.41

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
SCHEMBL5362266 0.85 HDAC3 (0.46) PAK1TLK2HDAC3HDAC4HDAC1
SCHEMBL5369667 0.84 HDAC3 (0.65) PAK1TLK2HDAC3HDAC4HDAC1
SCHEMBL5373331 0.82 TLK2 (0.67) TLK2HDAC3HDAC4HDAC1HDAC7
SCHEMBL5366320 0.79 FLT3 (0.54) TLK2HDAC3HDAC4HDAC1HDAC7
SCHEMBL8429168 0.78 PAK1 (0.68) PAK1TLK2HDAC3HDAC4HDAC1
SCHEMBL8429175 0.78 PAK1 (0.68) PAK1TLK2HDAC3HDAC4HDAC1
SCHEMBL8411247 0.77 MAPK1 (0.70) PAK1TLK2ROCK2PDGFRBKDR
SCHEMBL8411239 0.77 MAPK1 (0.70) PAK1TLK2ROCK2PDGFRBKDR
SCHEMBL5358704 0.76 AKT2 (0.60) —
SCHEMBL5364317 0.74 AKT2 (0.48) TLK2

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 PAK1 427/4885TLK2 48/4885HDAC3 4513/4885

“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.

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