SCHEMBL6315705

SCHEMBL6315705

COc1cccc(C(=O)Nc2onc(-c3ccccn3)c2C(N)=O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.53
SMN1; SMN2 Q16637 8/20 0.52
MAPT P10636 1/20 0.52
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
RAB9A P51151 7/20 0.48
NPC1 O15118 6/20 0.48
FLT3 P36888 1/20 0.48
HPGD P15428 2/20 0.48
NPSR1 Q6W5P4 2/20 0.48
TSHR P16473 1/20 0.48
MAPK10 P53779 1/20 0.48
HSD17B10 Q99714 1/20 0.48
KCNK3 O14649 1/20 0.46
KCNK9 Q9NPC2 1/20 0.46
LMNA P02545 3/20 0.46
HTT P42858 2/20 0.46
MITF O75030 1/20 0.46
AGTR1 P30556 1/20 0.46
OPRK1 P41145 1/20 0.46

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
SCHEMBL6317947 0.86 ADORA3 (0.51) ADORA3SMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL6317501 0.84 MAPT (0.53) SMN1; SMN2MAPTMEN1KMT2ARAB9A
SCHEMBL6314799 0.84 SMN1; SMN2 (0.47) SMN1; SMN2MEN1KMT2ARAB9ANPC1
SCHEMBL6316198 0.83 FLT3 (0.48) SMN1; SMN2MAPTMEN1KMT2ARAB9A
SCHEMBL6316651 0.82 ALDH1A1 (0.57) SMN1; SMN2MAPTMEN1KMT2ARAB9A
SCHEMBL6316034 0.82 ADORA3 (0.50) ADORA3SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL6317610 0.82 KDM4E (0.59) SMN1; SMN2MAPTMEN1KMT2ARAB9A
SCHEMBL6315971 0.80 TRPV1 (0.56) SMN1; SMN2MEN1KMT2AFLT3KCNK9
SCHEMBL6315689 0.80 FLT3 (0.48) SMN1; SMN2MAPTMEN1KMT2ARAB9A
SCHEMBL6316069 0.80 GRM1 (0.50) SMN1; SMN2MAPTMEN1KMT2ARAB9A

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 ADORA3 1471/4885SMN1; SMN2 2766/4885MAPT 281/4885

“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.