SCHEMBL6319161

SCHEMBL6319161

CC1CCCCC1NC(=O)c1c(-c2coc3ccccc23)noc1N

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 9/20 0.47
TAS1R1 Q7RTX1 9/20 0.47
TAS1R2 Q8TE23 9/20 0.47
POLB P06746 1/20 0.47
ALDH1A1 P00352 3/20 0.42
TSHR P16473 1/20 0.42
KMT2A Q03164 1/20 0.39
MAOB P27338 1/20 0.39
KCNH2 Q12809 1/20 0.38
LMNA P02545 1/20 0.38
RECQL P46063 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HIF1A Q16665 1/20 0.38
ATM Q13315 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37

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
SCHEMBL6316445 0.87 MAOB (0.52) POLBALDH1A1TSHRKMT2AMAOB
SCHEMBL6322682 0.86 MAOB (0.54) POLBALDH1A1KMT2AMAOBHIF1A
SCHEMBL6325219 0.86 MAOB (0.54) POLBALDH1A1KMT2AMAOBHIF1A
SCHEMBL6320666 0.85 MAOB (0.49) POLBALDH1A1TSHRKMT2AMAOB
SCHEMBL6316272 0.80 P2RX7 (0.42) ALDH1A1TSHRMAOBNPSR1HIF1A
SCHEMBL6323987 0.79 TAS1R3 (0.48) TAS1R3TAS1R1TAS1R2POLBALDH1A1
SCHEMBL6316864 0.79 RECQL (0.53) TAS1R3TAS1R1TAS1R2POLBALDH1A1
SCHEMBL6315929 0.78 RECQL (0.46) TAS1R3TAS1R1TAS1R2ALDH1A1TSHR
SCHEMBL6316005 0.78 HIF1A (0.42) ALDH1A1TSHRNPSR1HIF1A
SCHEMBL6315182 0.77 CA1 (0.39) ALDH1A1TSHRMAOBLMNA

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 7 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
US-20050059657-A1 Aminoisoxazole derivatives active as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2005-03-17 US disclosed
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 4258/4885TAS1R2 4472/4885

“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.