SCHEMBL6323312

SCHEMBL6323312

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
GAA P10253 1/20 0.46
SMN1; SMN2 Q16637 7/20 0.46
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
CYP1A2 P05177 1/20 0.46
ALDH1A1 P00352 6/20 0.45
LMNA P02545 5/20 0.45
POLB P06746 2/20 0.45
HTT P42858 2/20 0.45
KDM4E B2RXH2 2/20 0.45
MAPT P10636 2/20 0.45
TSHR P16473 2/20 0.44
ADORA3 P0DMS8 1/20 0.44
ADORA2A P29274 1/20 0.44
ADORA2B P29275 1/20 0.44
ADORA1 P30542 1/20 0.44
PKM P14618 3/20 0.44

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
SCHEMBL6315466 0.87 NAAA (0.47) MEN1KMT2AGAASMN1; SMN2ALDH1A1
SCHEMBL6318626 0.85 SMN1; SMN2 (0.47) HDAC3GAASMN1; SMN2ALDH1A1POLB
SCHEMBL6316902 0.85 MAPK14 (0.45) HDAC3MEN1KMT2AGAASMN1; SMN2
SCHEMBL6322628 0.84 HTT (0.45) GAASMN1; SMN2RAB9ANPC1HTT
SCHEMBL6323422 0.83 HTT (0.46) MEN1KMT2AGAASMN1; SMN2RAB9A
SCHEMBL6318230 0.82 SMN1; SMN2 (0.54) MEN1KMT2AGAASMN1; SMN2RAB9A
SCHEMBL6325190 0.82 HTT (0.46) HDAC3MEN1KMT2AGAASMN1; SMN2
SCHEMBL6318669 0.81 SMN1; SMN2 (0.53) MEN1KMT2AGAASMN1; SMN2RAB9A
SCHEMBL6324666 0.81 GAA (0.42) HDAC3MEN1KMT2AGAASMN1; SMN2
SCHEMBL6315769 0.81 L3MBTL1 (0.42) HDAC3MEN1KMT2AGAASMN1; SMN2

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 3 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

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 HDAC3 1462/4885MEN1 2789/4885KMT2A 1089/4885

“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.