SCHEMBL4137225

SCHEMBL4137225

Cc1nc2ccc(N3CCCCC3)cc2c(-c2ccc(F)cc2)c1C(C)Oc1cccc(C(N)=O)c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.41
CHEK2 O96017 4/20 0.40
PARP14 Q460N5 3/20 0.40
PARP10 Q53GL7 3/20 0.40
PARP1 P09874 1/20 0.40
MAT2A P31153 1/20 0.36
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
IDO2 Q6ZQW0 1/20 0.36
MAPT P10636 3/20 0.36
TP53 P04637 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SCN9A Q15858 1/20 0.36
FAAH O00519 1/20 0.35
ABCB1 P08183 1/20 0.35

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
SCHEMBL13881922 0.89 FGFR1 (0.38) F10IDO1TDO2IDO2MAPT
SCHEMBL3969725 0.86 SOS1 (0.36) IDO1TDO2IDO2MAPTSCN9A
SCHEMBL3966950 0.85 IDO1 (0.35) IDO1TDO2IDO2MAPTFAAH
SCHEMBL13881532 0.84 IDO1 (0.38) IDO1TDO2IDO2MAPT
SCHEMBL4071227 0.84 IDO1 (0.40) IDO1TDO2IDO2MAPT
SCHEMBL4143703 0.84 FGFR1 (0.39) IDO1TDO2IDO2MAPTSMN1; SMN2
SCHEMBL3970169 0.83 MAPK14 (0.41) F10CHEK2PARP14PARP10PARP1
SCHEMBL4139178 0.83 APP (0.41) IDO1TDO2IDO2MAPT
SCHEMBL3971049 0.82 FGFR1 (0.41) IDO1TDO2IDO2
SCHEMBL4075958 0.82 KDM4E (0.38) IDO1TDO2IDO2TP53SCN9A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090088441-A1 Quinoline Compounds ASTRAZENECA AB (SE) 2009-04-02 US claimed
WO-2009041904-A1 QUINOLINE COMPOUNDS HAVING AN ACTIVITY AGAINST THE GABAB RECEPTOR ASTRAZENECA AB (SE) 2009-04-02 WO disclosed
US-20090088441-A1 Quinoline Compounds ASTRAZENECA AB (SE) 2009-04-02 US disclosed
US-20090088441-A1 Quinoline Compounds ASTRAZENECA AB (SE) 2009-04-02 US disclosed
US-20090088441-A1 Quinoline Compounds ASTRAZENECA AB (SE) 2009-04-02 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-20090088441-A1 Quinoline Compounds GABRB1, HRH2, GABRA5 F10 2741/4885CHEK2 2593/4885PARP14 4395/4885

“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.