SCHEMBL6316741

SCHEMBL6316741

CCOC(=O)c1cccc(NC(=O)c2c(-c3nccs3)noc2N)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.52
MAPK1 P28482 2/20 0.52
RAB9A P51151 9/20 0.50
NPC1 O15118 8/20 0.50
SMN1; SMN2 Q16637 6/20 0.50
HPGD P15428 1/20 0.50
MAPT P10636 6/20 0.49
LMNA P02545 3/20 0.49
POLB P06746 2/20 0.49
TSHR P16473 1/20 0.49
TP53 P04637 1/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
PKM P14618 1/20 0.47
ALDH1A1 P00352 3/20 0.46
HTT P42858 2/20 0.46
ABCB1 P08183 1/20 0.46
ABCG2 Q9UNQ0 1/20 0.46
NR1H2 P55055 1/20 0.44
NR1H3 Q13133 1/20 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
SCHEMBL6315878 0.86 HSD17B10 (0.60) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL6316243 0.84 RAB9A (0.52) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL6319073 0.83 RAB9A (0.56) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL6316075 0.83 MAPK1 (0.51) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL6315774 0.81 RAB9A (0.56) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL6322686 0.80 CA1 (0.53) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL6314757 0.79 CYP1A2 (0.49) RAB9ANPC1SMN1; SMN2TP53MEN1
SCHEMBL6321873 0.78 RAB9A (0.53) HSD17B10MAPK1RAB9ANPC1SMN1; SMN2
SCHEMBL6317077 0.75 KMT2A (0.56) RAB9ANPC1SMN1; SMN2MAPTLMNA
SCHEMBL6315247 0.74 RAB9A (0.47) HSD17B10RAB9ANPC1SMN1; SMN2HPGD

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 HSD17B10 4152/4885MAPK1 178/4885RAB9A 1754/4885

“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.