SCHEMBL6316620

SCHEMBL6316620

NC(=O)c1c(-c2ccccn2)noc1NC(=O)c1ccccc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.44
ALDH1A1 P00352 2/20 0.44
GLA P06280 2/20 0.44
GAA P10253 2/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
HTT P42858 2/20 0.43
MAPT P10636 3/20 0.42
THRB P10828 1/20 0.42
GRM5 P41594 1/20 0.42
TDP1 Q9NUW8 2/20 0.42
KDM4E B2RXH2 2/20 0.42
TP53 P04637 2/20 0.42
HSD17B10 Q99714 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
GRM4 Q14833 1/20 0.41
LCLAT1 Q6UWP7 1/20 0.40
PKM P14618 1/20 0.40
AGTR1 P30556 1/20 0.40

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
SCHEMBL6316943 0.86 NPC1 (0.46) SMN1; SMN2ALDH1A1GAANPC1RAB9A
SCHEMBL6318340 0.84 KDM4E (0.47) SMN1; SMN2ALDH1A1NPC1RAB9AMAPT
SCHEMBL6316069 0.84 GRM1 (0.50) SMN1; SMN2NPC1RAB9AHTTMAPT
SCHEMBL6317088 0.83 HTT (0.53) SMN1; SMN2ALDH1A1GLAGAANPC1
SCHEMBL6314799 0.82 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1NPC1RAB9AGRM5
SCHEMBL6315883 0.80 SMN1; SMN2 (0.52) SMN1; SMN2ALDH1A1GLAGAANPC1
SCHEMBL6317827 0.80 TRPV1 (0.56) NPC1RAB9A
SCHEMBL6318669 0.80 SMN1; SMN2 (0.53) SMN1; SMN2ALDH1A1GAANPC1RAB9A
SCHEMBL6316034 0.80 ADORA3 (0.50) SMN1; SMN2ALDH1A1NPC1RAB9AMAPT
SCHEMBL6315971 0.78 TRPV1 (0.56) SMN1; SMN2TP53MEN1KMT2AAGTR1

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 2766/4885ALDH1A1 4444/4885GLA 1675/4885

“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.