SCHEMBL6315987

SCHEMBL6315987

NC(=O)c1c(-c2ccc3ccccc3n2)noc1NC(=O)C1CC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
TNIK Q9UKE5 1/20 0.41
SMO Q99835 6/20 0.40
ABL1 P00519 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
JAK2 O60674 1/20 0.39
TACR3 P29371 1/20 0.38
HPGD P15428 1/20 0.38
PLAU P00749 1/20 0.38
GSK3B P49841 2/20 0.38
ADORA3 P0DMS8 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 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
SCHEMBL6316137 0.81 ALDH1A1 (0.41) NPC1RAB9ASMOSMN1; SMN2HPGD
SCHEMBL6317779 0.81 RAB9A (0.49) NPC1RAB9AABL1SMN1; SMN2HPGD
SCHEMBL6316802 0.79 MAP4K4 (0.42) NPC1RAB9ASMN1; SMN2TACR3GSK3B
SCHEMBL6319745 0.78 ADORA1 (0.40) NPC1RAB9ASMOSMN1; SMN2TACR3
SCHEMBL6322895 0.78 SMN1; SMN2 (0.42) NPC1RAB9ASMN1; SMN2TACR3HPGD
SCHEMBL6318523 0.78 ADORA1 (0.38) NPC1RAB9ASMOSMN1; SMN2TACR3
SCHEMBL6322010 0.78 ADORA1 (0.41) NPC1RAB9ASMN1; SMN2HPGDGSK3B
SCHEMBL6321948 0.78 RAB9A (0.55) NPC1RAB9ASMN1; SMN2HPGDPLAU
SCHEMBL6319257 0.78 ALDH1A1 (0.39) NPC1RAB9ASMOSMN1; SMN2HPGD
SCHEMBL6317601 0.77 NPC1 (0.42) NPC1RAB9ASMN1; SMN2TACR3HPGD

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 3741/4885RAB9A 1754/4885TNIK 248/4885

“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.