SCHEMBL6319043

SCHEMBL6319043

Nc1onc(-c2coc3ccccc23)c1C(=O)NCc1ccccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.46
MAPT P10636 2/20 0.46
TP53 P04637 1/20 0.45
KMT2A Q03164 4/20 0.45
MEN1 O00255 2/20 0.43
ADORA2A P29274 2/20 0.43
ADORA1 P30542 2/20 0.43
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
ALOX15 P16050 1/20 0.43
APEX1 P27695 1/20 0.43
RECQL P46063 1/20 0.43
BCL2L1 Q07817 1/20 0.43
MCL1 Q07820 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 3/20 0.41
TSHR P16473 2/20 0.41
CYP2C19 P33261 2/20 0.41

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
SCHEMBL6315362 0.88 RXFP1 (0.46) NPC1MAPTTP53KMT2AMEN1
SCHEMBL6317961 0.88 ALDH1A1 (0.45) NPC1MAPTTP53KMT2AMEN1
SCHEMBL6315709 0.88 CHRNB2 (0.43) NPC1MAPTKMT2AMEN1ADORA2A
SCHEMBL6316239 0.88 HPGD (0.44) NPC1MAPTTP53KMT2AMEN1
SCHEMBL6324110 0.86 MAPT (0.50) NPC1MAPTTP53KMT2AL3MBTL1
SCHEMBL6324322 0.85 NTRK1 (0.43) NPC1KMT2AMEN1ADORA2AADORA1
SCHEMBL6316721 0.85 NPC1 (0.55) NPC1TP53KMT2AMEN1ADORA2A
SCHEMBL6315735 0.84 GAA (0.50) NPC1MAPTTP53KMT2AMEN1
SCHEMBL6316206 0.83 POLB (0.53) NPC1MAPTTP53KMT2AMEN1
SCHEMBL6317157 0.82 ALDH1A1 (0.52) NPC1MAPTTP53KMT2AMEN1

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 NPC1 3741/4885MAPT 281/4885TP53 609/4885

“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.