SCHEMBL4815048

SCHEMBL4815048

CCS(=O)(=O)Nc1cccc2c1CCC2=O

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.46
PSIP1 O75475 1/20 0.46
ADRA1A P35348 2/20 0.45
PARP14 Q460N5 2/20 0.44
BRD4 O60885 1/20 0.43
KIT P10721 1/20 0.42
FLT1 P17948 1/20 0.42
KDR P35968 1/20 0.42
ALDH1A1 P00352 2/20 0.41
GAA P10253 1/20 0.41
NR3C1 P04150 1/20 0.39
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL8312394 0.76 RAB9A (0.46) ALDH1A1GAALMNAHPGDSMN1; SMN2
SCHEMBL7102610 0.75 KEAP1 (0.47) ADRA2AADRA1APARP14ALDH1A1HPGD
SCHEMBL12768022 0.71 PSIP1 (0.73) PSIP1PARP14ALDH1A1NR3C1LMNA
SCHEMBL4814588 0.71 NPC1 (0.56) ADRA2APARP14ALDH1A1GAAHPGD
SCHEMBL9348518 0.71 MAPT (0.62) PSIP1PARP14BRD4ALDH1A1GAA
SCHEMBL1151568 0.71 ALDH1A1 (0.59) ALDH1A1GAAHPGD
SCHEMBL4815159 0.71 ALDH1A1 (0.55) KITFLT1KDRALDH1A1GAA
SCHEMBL7555603 0.69 BRD4 (0.42) ADRA2AADRA1ABRD4HPGDHTT
SCHEMBL28069822 0.68 STAT3 (0.46) ALDH1A1GAAHPGD
SCHEMBL7103288 0.68 BRD4 (0.40) ADRA2APSIP1BRD4LMNAHPGD

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 ADRA2A 4191/4885PSIP1 3118/4885ADRA1A 4434/4885

“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.