SCHEMBL6315898

SCHEMBL6315898

COc1ccc(-c2noc(N)c2C(=O)NCc2ccc(C)o2)cn1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 5/20 0.43
TSHR P16473 2/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40
CDK2 P24941 1/20 0.39
GSK3B P49841 1/20 0.39
MAPT P10636 1/20 0.39
KLKB1 P03952 1/20 0.38
ALDH1A1 P00352 2/20 0.38
CD274 Q9NZQ7 1/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.38
PKM P14618 1/20 0.38
HPGD P15428 1/20 0.38
ALOX12 P18054 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HSD17B10 Q99714 1/20 0.38

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
SCHEMBL6318329 0.85 TSHR (0.55) TSHRLMNARAB9AMAPTALDH1A1
SCHEMBL6323365 0.84 CDK2 (0.47) GABRA1LMNARAB9ACDK2GSK3B
SCHEMBL6324039 0.83 ALDH1A1 (0.52) GABRA1TSHRLMNARAB9ACDK2
SCHEMBL6324368 0.83 MAPT (0.44) GABRA1TSHRLMNARAB9ACDK2
SCHEMBL6316520 0.82 MAPT (0.52) TSHRLMNARAB9ACDK2GSK3B
SCHEMBL6317339 0.81 GABRA1 (0.53) GABRA1GSK3BNPSR1
SCHEMBL6323294 0.81 ALDH1A1 (0.53) TSHRLMNARAB9AMAPTALDH1A1
SCHEMBL6316080 0.81 ALDH1A1 (0.48) GABRA1CDK2GSK3BMAPTKLKB1
SCHEMBL6323900 0.81 GABRA1 (0.51) GABRA1TSHRLMNARAB9ACDK2
SCHEMBL6315038 0.81 RAB9A (0.50) LMNARAB9ACDK2GSK3BMAPT

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
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 GABRA1 886/4885TSHR 3971/4885LMNA 3334/4885

“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.