SCHEMBL6323876

SCHEMBL6323876

COc1ccc(-c2noc(N)c2C(=O)NC(C)CCc2ccccc2)cn1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.46
ACACB O00763 4/20 0.46
GABRA1 P14867 1/20 0.45
KMT2A Q03164 4/20 0.44
MEN1 O00255 3/20 0.44
HPGD P15428 3/20 0.44
HTT P42858 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
LMNA P02545 2/20 0.44
ACACA Q13085 3/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
POLB P06746 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL6315386 0.88 GABRA1 (0.49) ACACBGABRA1LMNA
SCHEMBL885658 0.86 GABRA1 (0.47) ACACBGABRA1LMNA
SCHEMBL6323390 0.86 GABRA1 (0.50) ACACBGABRA1SMN1; SMN2LMNA
SCHEMBL6317697 0.85 GABRA1 (0.47) ACACBGABRA1SMN1; SMN2LMNA
SCHEMBL6324006 0.85 MAPT (0.48) KMT2AMEN1HPGDHTTSMN1; SMN2
SCHEMBL6318899 0.85 GABRA1 (0.49) ACACBGABRA1HPGDHTTSMN1; SMN2
SCHEMBL6322798 0.85 GABRA1 (0.49) ACACBGABRA1LMNA
SCHEMBL6316368 0.84 GABRA1 (0.46) ACACBGABRA1SMN1; SMN2LMNA
SCHEMBL6321552 0.84 MAPK1 (0.52) ACACBGABRA1KMT2AMEN1HPGD
SCHEMBL6314761 0.84 GABRA5 (0.44) GABRA1LMNA

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 CNR1 3793/4885ACACB 1255/4885GABRA1 886/4885

“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.