SCHEMBL2495539

SCHEMBL2495539

O=C(Nc1ccc(Cl)c(CO)c1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.61
KCNK3 O14649 2/20 0.61
KCNK9 Q9NPC2 1/20 0.60
KCNQ3 O43525 2/20 0.60
KCNQ2 O43526 2/20 0.60
KCNE1 P15382 2/20 0.60
KCNQ1 P51787 2/20 0.60
P2RX1 P51575 1/20 0.60
LMNA P02545 1/20 0.60
PTGS1 P23219 2/20 0.60
KCNQ5 Q9NR82 1/20 0.59
CSF1R P07333 4/20 0.59
MEN1 O00255 1/20 0.58
HTT P42858 1/20 0.58
RAB9A P51151 1/20 0.58
KMT2A Q03164 1/20 0.58
TP53 P04637 1/20 0.58
RHOC P08134 1/20 0.58
RHOA P61586 1/20 0.58
CHRM4 P08173 1/20 0.57

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
SCHEMBL2492831 0.82 PTGS1 (0.70) MAPTKCNK3KCNK9KCNQ3KCNQ2
SCHEMBL14468045 0.82 MEN1 (0.68) MAPTKCNK3KCNK9KCNQ3KCNQ2
SCHEMBL2497820 0.81 CSF1R (0.70) MAPTKCNK3KCNK9KCNQ3KCNQ2
SCHEMBL22088439 0.81 MEN1 (0.70) MAPTKCNK3KCNK9KCNQ3KCNQ2
SCHEMBL5504593 0.81 MAPT (0.66) MAPTKCNK3KCNK9KCNQ3KCNQ2
SCHEMBL2495506 0.81 MAPT (0.61) MAPTKCNK3KCNK9KCNQ3KCNQ2
SCHEMBL5131380 0.80 RHOC (0.80) MAPTKCNK3KCNK9KCNQ3KCNQ2
SCHEMBL4286068 0.80 MAPT (0.94) MAPTKCNK3KCNK9KCNQ3KCNQ2
SCHEMBL17936112 0.80 MAPT (0.60) MAPTKCNK3KCNK9KCNQ3KCNQ2
SCHEMBL14445616 0.80 CSF1R (0.61) MAPTKCNK3KCNK9KCNQ3KCNQ2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030487-B2 2-amino—5-substituted pyrimidine inhibitors TARGEGEN, INC. (US) 2011-10-04 US disclosed
US-8030487-B2 2-amino—5-substituted pyrimidine inhibitors TARGEGEN, INC. (US) 2011-10-04 US disclosed
US-8030487-B2 2-amino—5-substituted pyrimidine inhibitors TARGEGEN, INC. (US) 2011-10-04 US disclosed
US-20080027070-A1 2-AMINO--5-SUBSTITUTED PYRIMIDINE INHIBITORS TARGEGEN, INC. (US) 2008-01-31 US disclosed
US-20080027070-A1 2-AMINO--5-SUBSTITUTED PYRIMIDINE INHIBITORS TARGEGEN, INC. (US) 2008-01-31 US disclosed
US-20080027070-A1 2-AMINO--5-SUBSTITUTED PYRIMIDINE INHIBITORS TARGEGEN, INC. (US) 2008-01-31 US disclosed
WO-2008008234-A1 2-AMINO-5-SUBSTITUTED PYRIMIDINE INHIBITORS TARGEGEN, INC. (US) 2008-01-17 WO disclosed
US-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations TARGEGEN, INC. (US) 2007-06-28 US disclosed
US-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations TARGEGEN, INC. (US) 2007-06-28 US disclosed
US-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations TARGEGEN, INC. (US) 2007-06-28 US disclosed
WO-2007056075-A2 SIX MEMBERED HETEROAROMATIC INHIBITORS TARGETING RESISTANT KINASE MUTATIONS TARGEGEN, INC. (US) 2007-05-18 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-20070149508-A1 Six membered heteroaromatic inhibitors targeting resistant kinase mutations ABL1, KDR, BCR MAPT 3282/4885KCNK3 2376/4885KCNK9 1780/4885
US-20080027070-A1 2-AMINO--5-SUBSTITUTED PYRIMIDINE INHIBITORS KDR, FLT4, FLT1 MAPT 3941/4885KCNK3 2714/4885KCNK9 2984/4885

“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.