SCHEMBL6725660

SCHEMBL6725660

CCNC(C(N)=O)n1c(C)c(C(=O)O)c(C)c1C=C1C(=O)Nc2ccc(F)cc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 4/20 0.52
▸ KDR P35968 12/20 0.47
▸ PRKAA1 Q13131 8/20 0.47
▸ PRKAA2 P54646 7/20 0.47
▸ TLK2 Q86UE8 4/20 0.47
▸ PDGFRB P09619 10/20 0.44
▸ FLT3 P36888 6/20 0.44
▸ HDAC3 O15379 2/20 0.44
▸ HDAC4 P56524 2/20 0.44
▸ HDAC1 Q13547 2/20 0.44
▸ HDAC7 Q8WUI4 2/20 0.44
▸ HDAC2 Q92769 2/20 0.44
▸ HDAC10 Q969S8 2/20 0.44
▸ HDAC11 Q96DB2 2/20 0.44
▸ HDAC8 Q9BY41 2/20 0.44
▸ HDAC6 Q9UBN7 2/20 0.44
▸ HDAC9 Q9UKV0 2/20 0.44
▸ HDAC5 Q9UQL6 2/20 0.44
▸ CSF1R P07333 6/20 0.44
▸ FGFR1 P11362 6/20 0.44

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
SCHEMBL722802 0.84 ALK (0.52) ALKKDRPRKAA1PRKAA2TLK2
SCHEMBL5518078 0.84 ALK (0.50) ALKKDRPRKAA1PRKAA2TLK2
SCHEMBL1673441 0.81 ALK (0.52) ALKKDRPRKAA1PRKAA2TLK2
SCHEMBL6727036 0.79 KDR (0.53) ALKKDRPRKAA1PRKAA2TLK2
SCHEMBL6722350 0.79 KDR (0.51) ALKKDRPRKAA1PRKAA2TLK2
SCHEMBL5642726 0.77 ALK (0.46) ALKKDRPRKAA1PRKAA2TLK2
SCHEMBL28900853 0.74 KDR (0.56) ALKKDRPRKAA1PRKAA2TLK2
SCHEMBL2116963 0.74 PDGFRB (0.46) ALKKDRPRKAA1PRKAA2PDGFRB
SCHEMBL2114116 0.73 LRRK2 (0.42) ALKKDRPRKAA1PRKAA2PDGFRB
SCHEMBL5642755 0.73 ALK (0.42) ALKKDRPRKAA1PRKAA2TLK2

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-20040152759-A1 Combination administration of an indolinone with a chemotherapeutic agent for cell proliferation disorders SUGEN, INC. 2004-08-05 — — US claimed
US-20040152759-A1 Combination administration of an indolinone with a chemotherapeutic agent for cell proliferation disorders SUGEN, INC. 2004-08-05 — — US disclosed
US-20030130280-A1 Treatment of acute myeloid leukemia with indolinone compounds SUGEN, INC. 2003-07-10 — — 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-20040152759-A1 Combination administration of an indolinone with a chemotherapeutic agent for cell proliferation disorders MKI67, CCNA1, CCNI ALK 4375/4885KDR 3687/4885PRKAA1 3094/4885
US-20030130280-A1 Treatment of acute myeloid leukemia with indolinone compounds FLT3, FLI1, MCL1 ALK 110/4885KDR 71/4885PRKAA1 1046/4885

“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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