SCHEMBL5728114

SCHEMBL5728114

COc1ccc2c(c1)NC(=O)/C2=C\c1ccc[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLK2 Q86UE8 6/20 1.00
PDPK1 O15530 3/20 0.81
FLT3 P36888 5/20 0.71
KDR P35968 5/20 0.71
KIT P10721 1/20 0.71
FLT4 P35916 1/20 0.71
AURKB Q96GD4 7/20 0.69
PDGFRB P09619 5/20 0.69
CHEK1 O14757 3/20 0.65
CHEK2 O96017 1/20 0.65
TUBB4A P04350 1/20 0.65
TUBB P07437 1/20 0.65
TUBA3C P0DPH7 1/20 0.65
TUBA1B P68363 1/20 0.65
TUBA4A P68366 1/20 0.65
TUBB4B P68371 1/20 0.65
TUBB3 Q13509 1/20 0.65
TUBB2A Q13885 1/20 0.65
TUBB8 Q3ZCM7 1/20 0.65
TUBA3E Q6PEY2 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
SCHEMBL5728118 1.00 TLK2 (1.00) TLK2PDPK1FLT3KDRKIT
SCHEMBL5728024 0.90 TLK2 (1.00) TLK2PDPK1FLT3KDRFLT4
SCHEMBL5728025 0.90 TLK2 (1.00) TLK2PDPK1FLT3KDRFLT4
SCHEMBL5728676 0.83 TLK2 (1.00) TLK2PDPK1FLT3KDRFLT4
SCHEMBL5728679 0.83 TLK2 (1.00) TLK2PDPK1FLT3KDRFLT4
SCHEMBL15328030 0.82 FLT3 (1.00) TLK2FLT3KDRKITFLT4
SCHEMBL18060032 0.82 FLT3 (1.00) TLK2FLT3KDRKITFLT4
SCHEMBL6966133 0.80 PDPK1 (0.77) TLK2PDPK1FLT3KDRKIT
SCHEMBL6955194 0.80 PDPK1 (0.77) TLK2PDPK1FLT3KDRKIT
SCHEMBL5728403 0.80 PDGFRB (0.80) TLK2PDPK1FLT3KDRKIT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050090541-A1 Indolinone derivatives and their use in treating disease-states such as cancer SCHERING AKTIENGESELLSCHAFT (DE) 2005-04-28 US claimed
US-7105563-B2 Indolinone derivatives and their use in treating disease-states such as cancer SCHERING AKTIENGESELLSCHAFT (DE) 2006-09-12 US disclosed
EP-1680401-A2 INDOLINONE DERIVATIVES AND THEIR USE IN TREATING DISEASE-STATES SUCH AS CANCER Schering Aktiengesellschaft (DE) 2006-07-19 EP disclosed
WO-2005040116-A2 INDOLINONE DERIVATIVES AND THEIR USE IN TREATING DISEASE-STATES SUCH AS CANCER SCHERING AKTIENGESELLSCHAFT (DE) 2005-05-06 WO disclosed
US-20050090541-A1 Indolinone derivatives and their use in treating disease-states such as cancer SCHERING AKTIENGESELLSCHAFT (DE) 2005-04-28 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 (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-20050090541-A1 Indolinone derivatives and their use in treating disease-states such as cancer PDK3, PDK2, PDK4 TLK2 847/4885PDPK1 4/4885FLT3 1806/4885

“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.