SCHEMBL6318669

SCHEMBL6318669

NC(=O)c1c(-c2ccccn2)noc1NC(=O)c1ccco1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 8/20 0.53
RAB9A P51151 7/20 0.53
NPC1 O15118 6/20 0.53
CYP1A2 P05177 2/20 0.53
ALDH1A1 P00352 7/20 0.52
KDM4E B2RXH2 5/20 0.52
LMNA P02545 3/20 0.52
MAPT P10636 3/20 0.52
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
POLB P06746 1/20 0.52
HTT P42858 1/20 0.52
ADORA3 P0DMS8 3/20 0.50
ADORA2A P29274 3/20 0.50
ADORA2B P29275 3/20 0.50
ADORA1 P30542 3/20 0.50
THRB P10828 1/20 0.47
TP53 P04637 2/20 0.47
HSD17B10 Q99714 2/20 0.47
PKM P14618 1/20 0.47

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
SCHEMBL6318230 0.90 SMN1; SMN2 (0.54) SMN1; SMN2RAB9ANPC1CYP1A2ALDH1A1
SCHEMBL6323312 0.81 HDAC3 (0.47) SMN1; SMN2RAB9ANPC1CYP1A2ALDH1A1
SCHEMBL6316874 0.81 IKBKE (0.57) SMN1; SMN2RAB9ANPC1CYP1A2ALDH1A1
SCHEMBL6314886 0.80 MAPT (0.50) SMN1; SMN2RAB9ANPC1CYP1A2ALDH1A1
SCHEMBL6316069 0.80 GRM1 (0.50) SMN1; SMN2RAB9ANPC1MAPTKMT2A
SCHEMBL6316620 0.80 SMN1; SMN2 (0.44) SMN1; SMN2RAB9ANPC1ALDH1A1KDM4E
SCHEMBL6316034 0.80 ADORA3 (0.50) SMN1; SMN2RAB9ANPC1ALDH1A1LMNA
SCHEMBL6316943 0.80 NPC1 (0.46) SMN1; SMN2RAB9ANPC1ALDH1A1KDM4E
SCHEMBL6321792 0.79 F2 (0.43) SMN1; SMN2RAB9ANPC1ALDH1A1MAPT
SCHEMBL6316823 0.79 POLB (0.54) SMN1; SMN2RAB9ANPC1ALDH1A1KDM4E

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 SMN1; SMN2 2766/4885RAB9A 1754/4885NPC1 3741/4885

“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.