SCHEMBL4889149

SCHEMBL4889149

Cc1cc(Cn2cncn2)cc2c1CCC2=O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 17/20 0.41
UGT1A4 P22310 1/20 0.41
PDE4D Q08499 1/20 0.41
HDAC1 Q13547 2/20 0.36
HDAC6 Q9UBN7 2/20 0.36
STS P08842 1/20 0.36

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
SCHEMBL4816603 0.84 CYP19A1 (0.41) CYP19A1UGT1A4PDE4DHDAC1HDAC6
SCHEMBL4815085 0.79 HTT (0.39) HDAC1HDAC6
SCHEMBL4816693 0.76 CYP11B1 (0.52) CYP19A1
SCHEMBL4820201 0.76 CYP19A1 (0.41) CYP19A1
SCHEMBL4811817 0.76 CYP19A1 (0.50) CYP19A1HDAC1HDAC6STS
SCHEMBL4816893 0.74 QPCT (0.34)
SCHEMBL4815195 0.73 CYP19A1 (0.50) CYP19A1HDAC1HDAC6STS
SCHEMBL4815901 0.71 MAPT (0.42) HDAC6
SCHEMBL4814816 0.71 ALDH1A1 (0.44)
SCHEMBL4815667 0.71 WDR5 (0.42)

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 CYP19A1 2367/4885UGT1A4 3629/4885PDE4D 1444/4885

“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.