SCHEMBL6324905

SCHEMBL6324905

CCC(CC)NC(=O)c1c(-c2coc3ccccc23)noc1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.42
TAS1R1 Q7RTX1 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.39
TP53 P04637 2/20 0.39
LMNA P02545 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
TACR3 P29371 6/20 0.36
TACR2 P21452 2/20 0.36
MAOB P27338 2/20 0.36
IKBKE Q14164 1/20 0.36
TBK1 Q9UHD2 1/20 0.36
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA4 P22748 2/20 0.35
CA7 P43166 2/20 0.35
PSMB8 P28062 1/20 0.35
PSMB5 P28074 1/20 0.35
GRK2 P25098 1/20 0.34

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
SCHEMBL6316505 0.91 RAB9A (0.42) L3MBTL1TP53LMNANPSR1ALDH1A1
SCHEMBL6317238 0.87 L3MBTL1 (0.44) L3MBTL1LMNAALDH1A1MAOBIKBKE
SCHEMBL6323394 0.86 L3MBTL1 (0.37) L3MBTL1LMNAALDH1A1TACR3TACR2
SCHEMBL6323271 0.85 ACACB (0.37) TAS1R3TAS1R1L3MBTL1MAOBIKBKE
SCHEMBL6317875 0.84 L3MBTL1 (0.52) L3MBTL1TP53LMNANPSR1ALDH1A1
SCHEMBL6315860 0.84 L3MBTL1 (0.38) TAS1R3TAS1R1L3MBTL1MAOBIKBKE
SCHEMBL6324816 0.84 ALDH1A1 (0.44) L3MBTL1ALDH1A1HTTTACR3TACR2
SCHEMBL6323089 0.84 NPC1 (0.44) L3MBTL1TP53LMNANPSR1ALDH1A1
SCHEMBL6316467 0.83 L3MBTL1 (0.38) TAS1R3TAS1R1L3MBTL1TACR3MAOB
SCHEMBL6316589 0.83 KMT2A (0.43) L3MBTL1NPSR1ALDH1A1HTTMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US claimed
CN-1549714-A Aminoisoxazole derivatives active as kinase inhibitors 2004-11-24 CN claimed
EP-1435948-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-07-14 EP claimed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 WO claimed
EP-1435948-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-07-14 EP disclosed
WO-2003013517-A1 AMINOISOXAZOLE DERIVATIVES ACTIVE AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2003-02-20 WO 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-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors MAP3K9, MAP3K19, MAP4K2 TAS1R3 4289/4885TAS1R1 4258/4885L3MBTL1 4176/4885

“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.