SCHEMBL6318751

SCHEMBL6318751

COCC(=O)Nc1onc(-c2cccs2)c1C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.53
ALDH1A1 P00352 4/20 0.53
HSD17B10 Q99714 3/20 0.53
KDM4E B2RXH2 2/20 0.53
AHR P35869 1/20 0.53
USP2 O75604 1/20 0.46
THRB P10828 3/20 0.43
RAB9A P51151 3/20 0.43
LMNA P02545 2/20 0.43
NPSR1 Q6W5P4 2/20 0.41
PKM P14618 1/20 0.41
MAPT P10636 9/20 0.41
RET P07949 1/20 0.40
TP53 P04637 3/20 0.40
POLB P06746 1/20 0.40
NPC1 O15118 2/20 0.39
ATM Q13315 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MEN1 O00255 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
SCHEMBL6321895 0.85 MAPT (0.54) HPGDALDH1A1HSD17B10USP2THRB
SCHEMBL6317632 0.85 ADORA2A (0.53) HPGDALDH1A1HSD17B10KDM4EUSP2
SCHEMBL6315136 0.84 ALDH1A1 (0.47) HPGDALDH1A1HSD17B10KDM4EUSP2
SCHEMBL6321734 0.84 ALDH1A1 (0.53) HPGDALDH1A1HSD17B10KDM4EUSP2
SCHEMBL6316568 0.84 USP2 (0.51) USP2THRBRAB9ALMNANPSR1
SCHEMBL6315274 0.83 ADORA2A (0.46) ALDH1A1HSD17B10KDM4EUSP2RAB9A
SCHEMBL6315220 0.81 KDM4E (0.56) HPGDALDH1A1HSD17B10KDM4EUSP2
SCHEMBL6315244 0.81 MAPK14 (0.43) HPGDALDH1A1HSD17B10KDM4ERAB9A
SCHEMBL6316058 0.81 NPC1 (0.38) HPGDALDH1A1HSD17B10KDM4EAHR
SCHEMBL6315833 0.81 KIT (0.48) HPGDALDH1A1HSD17B10KDM4ERAB9A

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 HPGD 2923/4885ALDH1A1 4444/4885HSD17B10 4152/4885

“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.