SCHEMBL6316420

SCHEMBL6316420

NC(=O)c1c(-c2ccsc2)noc1NC(=O)c1cccc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
MMP3 P08254 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
CNR1 P21554 1/20 0.40
DEGS1 O15121 1/20 0.39
ANO1 Q5XXA6 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
PDE5A O76074 1/20 0.39
PDE1A P54750 1/20 0.39
PDE1B Q01064 1/20 0.39
PDE1C Q14123 1/20 0.39
MAPT P10636 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HPGD P15428 2/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
PLK1 P53350 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
SCHEMBL27591720 0.87 CCNE2 (0.39) ALDH1A1MMP3HDAC8CNR1DEGS1
SCHEMBL6316493 0.86 SMN1; SMN2 (0.43) ALDH1A1MMP3HDAC8CNR1DEGS1
SCHEMBL6322761 0.85 FLT3 (0.45) ALDH1A1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL6317872 0.85 NPC1 (0.44) ALDH1A1ANO1NPC1RAB9ASMN1; SMN2
SCHEMBL6318471 0.83 ALDH1A1 (0.45) ALDH1A1MMP3HDAC8CNR1DEGS1
SCHEMBL6316187 0.82 KIT (0.46) ALDH1A1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL27591617 0.82 ANO1 (0.41) ALDH1A1MMP3HDAC8CNR1ANO1
SCHEMBL6314663 0.81 CYP2C9 (0.46) ALDH1A1NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL6315365 0.81 NPC1 (0.43) ALDH1A1DEGS1NPC1RAB9AKDM4E
SCHEMBL6318340 0.79 KDM4E (0.47) ALDH1A1CNR1DEGS1NPC1RAB9A

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 ALDH1A1 4444/4885MMP3 4142/4885HDAC8 587/4885

“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.