SCHEMBL14519103

SCHEMBL14519103

Cc1cc(C)c(/C=C2\C(=O)Nc3ccc(C(=O)O)cc32)[nH]1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLK2 Q86UE8 2/20 0.82
KDR P35968 7/20 0.72
PDPK1 O15530 3/20 0.72
RET P07949 10/20 0.71
PDGFRB P09619 6/20 0.71
FLT3 P36888 4/20 0.68
ALK Q9UM73 4/20 0.68
FGFR1 P11362 4/20 0.65
CSF1R P07333 2/20 0.65
SRC P12931 2/20 0.65
FLT1 P17948 2/20 0.65
FGFR3 P22607 2/20 0.65
MAPK1 P28482 2/20 0.65
FLT4 P35916 2/20 0.65
PDGFRA P16234 2/20 0.65
ABL1 P00519 2/20 0.65
JAK3 P52333 2/20 0.65
MEN1 O00255 1/20 0.65
NPC1 O15118 1/20 0.65
GMNN O75496 1/20 0.65

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
SCHEMBL16568378 1.00 TLK2 (0.82) TLK2KDRPDPK1RETPDGFRB
SCHEMBL5362637 0.87 TLK2 (0.77) TLK2KDRPDPK1RETPDGFRB
SCHEMBL5367740 0.86 TLK2 (0.75) TLK2KDRPDPK1RETPDGFRB
SCHEMBL5369648 0.85 TLK2 (0.74) TLK2KDRPDPK1RETPDGFRB
SCHEMBL5361474 0.85 TLK2 (0.70) TLK2KDRPDPK1RETPDGFRB
SCHEMBL5478517 0.84 PDPK1 (1.00) TLK2KDRPDPK1RETPDGFRB
SCHEMBL5203211 0.84 PDPK1 (1.00) TLK2KDRPDPK1RETPDGFRB
SCHEMBL17480334 0.83 TLK2 (0.68) TLK2KDRPDPK1RETPDGFRB
SCHEMBL30685927 0.82 TLK2 (0.70) TLK2KDRPDPK1RETPDGFRB
SCHEMBL5368286 0.82 PAK4 (0.69) TLK2KDRPDPK1RETPDGFRB

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-9458463-B2 Method for treatment of diabetes by a small molecule inhibitor for GRK5 MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2016-10-04 US claimed
US-20170240522-A1 BENZOTHIOPHENE, BENZYLOXYBENZYLIDENE AND INDOLINE DERIVATIVES USEFUL FOR THE TREATMENT OF TUBERCULOSIS ÉCOLE POLYTECHNIQUE FÉDÉRALE DE LAUSANNE (EPFL) (CH) 2017-08-24 US disclosed
US-20170240522-A1 BENZOTHIOPHENE, BENZYLOXYBENZYLIDENE AND INDOLINE DERIVATIVES USEFUL FOR THE TREATMENT OF TUBERCULOSIS ÉCOLE POLYTECHNIQUE FÉDÉRALE DE LAUSANNE (EPFL) (CH) 2017-08-24 US disclosed
US-9458463-B2 Method for treatment of diabetes by a small molecule inhibitor for GRK5 MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2016-10-04 US disclosed
WO-2016041972-A1 BENZOTHIOPHENE, BENZYLOXYBENZYLIDENE AND INDOLINE DERIVATIVES USEFUL FOR THE TREATMENT OF TUBERCULOSIS ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) 2016-03-24 WO disclosed
US-20150079108-A1 KINASES AS TARGETS FOR ANTI-DIABETIC THERAPY MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2015-03-19 US disclosed
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-7202265-B2 Indolinone combinatorial libraries and related products and methods for the treatment of disease SUGEN, INC. (US) 2007-04-10 US 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-20150079108-A1 KINASES AS TARGETS FOR ANTI-DIABETIC THERAPY GCKR, GRK4, GRK5 TLK2 143/4885KDR 1123/4885PDPK1 41/4885
US-20170240522-A1 BENZOTHIOPHENE, BENZYLOXYBENZYLIDENE AND INDOLINE DERIVATIVES USEFUL FOR THE TREATMENT OF TUBERCULOSIS INMT, IDO2, IDO1 TLK2 1108/4885KDR 4818/4885PDPK1 1142/4885

“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.