SCHEMBL4818928

SCHEMBL4818928

CC(C)(C)OC(=O)CNC(=O)c1cc(Br)cc2c1CCC2=O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 2/20 0.43
CALCA P06881 1/20 0.36
KDM4E B2RXH2 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
MAPT P10636 3/20 0.32
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 2/20 0.32
POLB P06746 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL4817596 0.80 PTPRC (0.50) PTPRCL3MBTL1MAPTALDH1A1
SCHEMBL27903118 0.72 KDM4E (0.40) KDM4EMAPTALDH1A1SMN1; SMN2HPGD
SCHEMBL1843561 0.70 ALDH1A1 (0.49) KDM4EL3MBTL1MTNR1AMTNR1BMAPT
SCHEMBL26566722 0.69 USP30 (0.53) PTPRCALDH1A1SMN1; SMN2HPGD
SCHEMBL31724800 0.69 USP30 (0.53) PTPRCALDH1A1SMN1; SMN2HPGD
SCHEMBL4812280 0.69 AKR1C3 (0.45) KDM4EMAPTALDH1A1SMN1; SMN2HPGD
SCHEMBL16116065 0.69 EED (0.57)
SCHEMBL7842881 0.68 ALDH1A1 (0.46) KDM4EALDH1A1SMN1; SMN2POLBHSD17B10
SCHEMBL30572070 0.67 KMT2A (0.56) PTPRCL3MBTL1ALDH1A1SMN1; SMN2HPGD
SCHEMBL20451400 0.66 TGM2 (0.48)

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
EP-1740579-B1 TRICYCLIC PYRAZOLE KINASE INHIBITORS ABBVIE INC (US) 2015-08-19 EP disclosed
US-7468371-B2 Tricyclic pyrazole kinase inhibitors ABBOTT LABORATORIES INC. (US) 2008-12-23 US disclosed
US-20060014816-A1 Tricyclic pyrazole kinase inhibitors ABBVIE INC. 2006-01-19 US 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-20060014816-A1 Tricyclic pyrazole kinase inhibitors PRKDC, PRKACA, PIK3C3 PTPRC 336/4885CALCA 4703/4885KDM4E 1449/4885

“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.