SCHEMBL4131807

SCHEMBL4131807

Cc1nc2ccc(N3CCCCC3)cc2c(-c2ccc(F)cc2)c1C(C)Oc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 1/20 0.38
FGFR1 P11362 5/20 0.37
ABL1 P00519 2/20 0.37
FLT1 P17948 2/20 0.37
BCR P11274 1/20 0.37
MAP4K1 Q92918 1/20 0.36
MAPT P10636 1/20 0.35
PRMT5 O14744 2/20 0.35
ALK Q9UM73 1/20 0.35
PDE10A Q9Y233 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
KCNH2 Q12809 1/20 0.35
MCL1 Q07820 1/20 0.35
IDO1 P14902 1/20 0.35
TDO2 P48775 1/20 0.35
IDO2 Q6ZQW0 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
SCHEMBL4071227 0.88 IDO1 (0.40) FGFR1MAPTALKIDO1TDO2
SCHEMBL4139178 0.87 APP (0.41) FGFR1MAPTIDO1TDO2IDO2
SCHEMBL13881532 0.87 IDO1 (0.38) FGFR1MAPTIDO1TDO2IDO2
SCHEMBL3971049 0.87 FGFR1 (0.41) FGFR1IDO1TDO2IDO2
SCHEMBL4075958 0.86 KDM4E (0.38) SOS1FGFR1IDO1TDO2IDO2
SCHEMBL4198373 0.84 KCNH2 (0.39) FGFR1ABL1FLT1BCRMAP4K1
SCHEMBL3964275 0.84 IDO1 (0.40) FGFR1IDO1TDO2IDO2
SCHEMBL13881922 0.83 FGFR1 (0.38) FGFR1MAPTIDO1TDO2IDO2
SCHEMBL4138762 0.83 ELOVL1 (0.37) FGFR1MAPTIDO1TDO2IDO2
SCHEMBL4143703 0.83 FGFR1 (0.39) FGFR1MAPTIDO1TDO2IDO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 SOS1 2662/4885FGFR1 1291/4885ABL1 2380/4885

“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.