SCHEMBL2908095

SCHEMBL2908095

COc1cc(NC=C(C(=O)O)C(=O)O)ccc1Br

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 1/20 0.47
GAA P10253 4/20 0.47
KDM4E B2RXH2 3/20 0.47
POLB P06746 2/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 6/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
STAT1 P42224 1/20 0.42
ALDH1A1 P00352 5/20 0.41
EGFR P00533 1/20 0.40
ABCG2 Q9UNQ0 2/20 0.39
ABCB1 P08183 1/20 0.39
ABCC1 P33527 1/20 0.39
MEN1 O00255 1/20 0.39
GFER P55789 1/20 0.39
KMT2A Q03164 1/20 0.39
P2RX3 P56373 1/20 0.39
LCK P06239 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
SCHEMBL2904221 0.88 ALDH1A1 (0.47) GAAKDM4EPOLBLMNAMAPT
SCHEMBL5706881 0.86 GAA (0.61) GAAKDM4EPOLBLMNAMAPT
SCHEMBL3846169 0.79 LMNA (0.50) GAAKDM4EPOLBLMNAMAPT
SCHEMBL2723490 0.79 ALDH1A1 (0.57) GRM4GAAKDM4EPOLBLMNA
SCHEMBL7291739 0.79 GAA (0.50) GAAKDM4EPOLBLMNAMAPT
SCHEMBL12555538 0.78 GRM4 (0.47) GRM4GAAKDM4EPOLBLMNA
SCHEMBL20258223 0.78 RAB9A (0.42) KDM4EPOLBLMNAMAPTNPC1
SCHEMBL29550233 0.77 GAA (0.36) GRM4GAAKDM4EPOLBLMNA
SCHEMBL2905222 0.77 RAB9A (0.40) POLBMAPTNPC1RAB9ASMN1; SMN2
SCHEMBL15972268 0.76 GRM4 (0.59) GRM4LMNAMAPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2010496-B1 4-ANILINOQUINOLINE-3-CARBOXAMIDES AS CSF-1R KINASE INHIBITORS ASTRAZENECA AB (SE) 2010-08-25 EP disclosed
US-20090270450-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2009-10-29 US disclosed
EP-2084134-A1 CHEMICAL COMPOUNDS AstraZeneca AB (SE) 2009-08-05 EP disclosed
US-20090054411-A1 4-ANILINOQUINOLINE-3-CARBOXAMIDES AS CSF-1R KINASE INHIBITORS ASTRAZENECA AB (SE) 2009-02-26 US disclosed
EP-2010496-A1 4-ANILINOQUINOLINE-3-CARBOXAMIDES AS CSF-1R KINASE INHIBITORS AstraZeneca AB (SE) 2009-01-07 EP disclosed
WO-2008056148-A1 CHEMICAL COMPOUNDS ASTRAZENECA AB (SE) 2008-05-15 WO disclosed
WO-2007119046-A1 4-ANILINOQUINOLINE-3-CARBOXAMIDES AS CSF-1R KINASE INHIBITORS ASTRAZENECA AB (SE) 2007-10-25 WO 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 (2 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-20090054411-A1 4-ANILINOQUINOLINE-3-CARBOXAMIDES AS CSF-1R KINASE INHIBITORS CSF1R, CSF3R, FLT3 GRM4 1743/4885GAA 2212/4885KDM4E 762/4885
US-20090270450-A1 CHEMICAL COMPOUNDS CSF1R, CSF3R, FLT3 GRM4 2406/4885GAA 1479/4885KDM4E 1916/4885

“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.