SCHEMBL6316264

SCHEMBL6316264

CCCCCCCNC(=O)c1c(-c2ccc(Br)s2)noc1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
ESR1 P03372 1/20 0.44
HPGD P15428 1/20 0.43
RXFP1 Q9HBX9 3/20 0.42
GAA P10253 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ALOX15 P16050 3/20 0.42
TP53 P04637 2/20 0.40
CA2 P00918 2/20 0.40
CA1 P00915 1/20 0.40
CA4 P22748 1/20 0.40
CA7 P43166 1/20 0.40
MAPT P10636 1/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
NAAA Q02083 2/20 0.40
NCOR2 Q9Y618 2/20 0.40
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC2 Q92769 1/20 0.40

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
SCHEMBL6315933 1.00 KDM4E (0.44) KDM4EESR1HPGDRXFP1GAA
SCHEMBL6315650 1.00 KDM4E (0.44) KDM4EESR1HPGDRXFP1GAA
SCHEMBL6323150 0.99 RXFP1 (0.43) KDM4EESR1HPGDRXFP1GAA
SCHEMBL6324099 0.96 CA1 (0.41) KDM4EESR1HPGDRXFP1GAA
SCHEMBL6317494 0.91 RAB9A (0.43) KDM4EESR1HPGDRXFP1GAA
SCHEMBL6318198 0.90 RXFP1 (0.46) KDM4EESR1RXFP1GAANPSR1
SCHEMBL6319057 0.89 ALOX15 (0.43) HPGDGAAALOX15TP53CA2
SCHEMBL6324330 0.89 ALOX15 (0.43) HPGDGAAALOX15TP53CA2
SCHEMBL6322769 0.89 ALOX15 (0.43) HPGDGAAALOX15TP53CA2
SCHEMBL6317695 0.88 ALOX15 (0.43) HPGDGAAALOX15TP53CA2

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 KDM4E 1382/4885ESR1 2759/4885HPGD 2923/4885

“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.