SCHEMBL1407904

SCHEMBL1407904

N#Cc1ccc(-c2ccc(N)cc2C(F)(F)F)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.59
POLB P06746 1/20 0.59
GAA P10253 1/20 0.59
TSHR P16473 1/20 0.59
KIF11 P52732 3/20 0.51
NSD2 O96028 1/20 0.44
CYP11B2 P19099 1/20 0.42
AR P10275 5/20 0.42
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
PDK2 Q15119 1/20 0.40
PTPN5 P54829 1/20 0.40
TRPV4 Q9HBA0 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
KDM1A O60341 3/20 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
SCHEMBL28668535 0.86 KIF11 (0.57) KIF11NSD2CYP11B2ARPDK2
Water SCHEMBL29003781 0.86 GAA (0.73) GLAPOLBGAATSHRKIF11
SCHEMBL29964278 0.86 GAA (0.79) GLAPOLBGAATSHRKIF11
SCHEMBL7868530 0.86 GAA (0.79) GLAPOLBGAATSHRKIF11
SCHEMBL397926 0.85 KIF11 (0.65) KIF11NSD2CYP11B2ARPDK2
SCHEMBL24297388 0.84 GAA (0.76) GLAPOLBGAATSHRKIF11
SCHEMBL1011735 0.84 GAA (0.76) GLAPOLBGAATSHRKIF11
SCHEMBL27537618 0.83 GAA (0.73) GLAPOLBGAATSHRKIF11
SCHEMBL1360894 0.82 KIF11 (0.62) KIF11NSD2CYP11B2ARPDK2
SCHEMBL17629903 0.81 KIF11 (0.51) KIF11NSD2CYP11B2ARPDK2

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
WO-2016046782-A1 IMIDAZOLE BIARYL COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2016-03-31 WO disclosed
US-20120184561-A1 PHENYLACETAMIDES SUITABLE AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2012-07-19 US disclosed
US-8030311-B2 Phenylacetamides suitable as protein kinase inhibitors NOVARTIS AG (CH) 2011-10-04 US disclosed
EP-1874770-B1 PHENYLACETAMIDES SUITABLE AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2011-03-09 EP disclosed
US-20080319005-A1 Phenylacetamides Suitable as Protein Kinase Inhibitors NOVARTIS AG (CH) 2008-12-25 US disclosed
EP-1874770-A1 PHENYLACETAMIDES SUITABLE AS PROTEIN KINASE INHIBITORS Novartis Pharma AG (CH) 2008-01-09 EP disclosed
WO-2006108640-A1 PHENYLACETAMIDES SUITABLE AS PROTEIN KINASE INHIBITORS NOVARTIS AG (CH) 2006-10-19 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-20120184561-A1 PHENYLACETAMIDES SUITABLE AS PROTEIN KINASE INHIBITORS MAP3K10, MAP3K20, MAP3K9 GLA 3438/4885POLB 1988/4885GAA 2819/4885
US-20080319005-A1 Phenylacetamides Suitable as Protein Kinase Inhibitors MAP3K20, MAP3K10, MAP3K9 GLA 3361/4885POLB 2136/4885GAA 2518/4885

“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.