SCHEMBL6318971

SCHEMBL6318971

CCCCC(CC)CNC(=O)c1c(-c2coc3ccccc23)noc1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
HTT P42858 3/20 0.41
GLA P06280 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAP4K1 Q92918 1/20 0.39
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 3/20 0.36
MAOB P27338 1/20 0.36
LMNA P02545 2/20 0.36
POLB P06746 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MAPK1 P28482 1/20 0.36
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 1/20 0.35
RXFP1 Q9HBX9 1/20 0.34
P2RX7 Q99572 1/20 0.34
GAA P10253 1/20 0.33
GABRA5 P31644 1/20 0.33
MAPT P10636 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL6314864 0.86 MAOB (0.45) TSHRHTTL3MBTL1KMT2AALDH1A1
SCHEMBL6316873 0.85 MAOB (0.44) TSHRHTTGLAL3MBTL1ALDH1A1
SCHEMBL6316589 0.85 KMT2A (0.43) HTTGLAL3MBTL1KMT2AALDH1A1
SCHEMBL6316311 0.84 MAOB (0.43) TSHRHTTGLAL3MBTL1ALDH1A1
SCHEMBL6318968 0.84 MAOB (0.43) TSHRHTTGLAL3MBTL1ALDH1A1
SCHEMBL6321222 0.84 MAOB (0.43) TSHRHTTGLAL3MBTL1ALDH1A1
SCHEMBL6315860 0.81 L3MBTL1 (0.38) L3MBTL1MAOBPOLB
SCHEMBL6618490 0.81 L3MBTL1 (0.36) L3MBTL1KMT2AALDH1A1MAOBLMNA
SCHEMBL6317244 0.81 KDM4E (0.40) TSHRHTTGLAL3MBTL1KMT2A
SCHEMBL6316467 0.81 L3MBTL1 (0.38) L3MBTL1MAOBPOLB

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 7 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
CN-1549714-A Aminoisoxazole derivatives active as kinase inhibitors 2004-11-24 CN 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 TSHR 3971/4885HTT 2134/4885GLA 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.