SCHEMBL3734869

SCHEMBL3734869

NC(=O)c1sc(-n2cnc3cnccc32)cc1OCc1ccc(F)cc1C(F)(F)F

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 19/20 0.66
NEK2 P51955 4/20 0.66
CSF1R P07333 3/20 0.66
KDR P35968 3/20 0.66
LIMK1 P53667 3/20 0.66
STK3 Q13188 3/20 0.66
DYRK1A Q13627 3/20 0.66
BRSK1 Q8TDC3 3/20 0.66
PLK3 Q9H4B4 3/20 0.66
CLK4 Q9HAZ1 3/20 0.66
MAP4K5 Q9Y4K4 3/20 0.66
MAP4K4 O95819 2/20 0.66
SLK Q9H2G2 2/20 0.66
PIM1 P11309 2/20 0.66
PKN2 Q16513 2/20 0.66
HIPK4 Q8NE63 2/20 0.66
AURKB Q96GD4 2/20 0.66
CAMK2B Q13554 1/20 0.66
CAMK2G Q13555 1/20 0.66
CAMK2D Q13557 1/20 0.66

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
SCHEMBL3739454 0.93 PLK1 (0.66) PLK1NEK2CSF1RKDRLIMK1
SCHEMBL3739899 0.90 PLK1 (0.53) PLK1NEK2CSF1RKDRLIMK1
SCHEMBL3734449 0.90 PLK1 (0.82) PLK1NEK2CSF1RKDRLIMK1
SCHEMBL3747967 0.84 PLK1 (0.73) PLK1NEK2CSF1RKDRLIMK1
SCHEMBL3734894 0.84 PLK1 (0.53) PLK1NEK2CSF1RKDRLIMK1
SCHEMBL3739950 0.84 PLK1 (0.81) PLK1NEK2CSF1RKDRLIMK1
SCHEMBL3734905 0.83 PLK1 (0.82) PLK1NEK2CSF1RKDRLIMK1
SCHEMBL3745124 0.83 PLK1 (0.64) PLK1NEK2CSF1RKDRLIMK1
SCHEMBL3746667 0.81 PLK1 (0.64) PLK1NEK2CSF1RKDRLIMK1
SCHEMBL3736022 0.81 PLK1 (0.61) PLK1NEK2CSF1RKDRLIMK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160158267-A1 METHODS OF PREVENTING, REDUCING OR TREATING MACULAR DEGENERATION INOTEK PHARMACEUTICALS CORPORATION 2016-06-09 US disclosed
EP-2424546-B1 METHOD OF REDUCING INTRAOCULAR PRESSURE IN HUMANS INOTEK PHARMACEUTICALS CORP (US) 2015-10-28 EP disclosed
US-20140275128-A1 METHOD OF PROVIDING OCULAR NEUROPROTECTION INOTEK PHARMACEUTICALS CORPORATION (US) 2014-09-18 US disclosed
US-20130217643-A1 METHOD OF REDUCING INTRAOCULAR PRESSURE IN HUMANS INOTEK PHARMACEUTICALS CORPORATION (US) 2013-08-22 US disclosed
US-8470800-B2 Method of reducing intraocular pressure in humans INOTEK PHARMACEUTICALS CORPORATION (US) 2013-06-25 US disclosed
US-8273890-B2 Thiophene-imidazopyridines 4SC AG (DE) 2012-09-25 US disclosed
US-20100278833-A1 THIOPHENE-IMIDAZOPYRIDINES 4SC AG (DE) 2010-11-04 US disclosed
US-20100279970-A1 METHOD OF REDUCING INTRAOCULAR PRESSURE IN HUMANS INOTEK PHARMACEUTICALS CORPORATION (US) 2010-11-04 US disclosed
WO-2009003911-A1 THIOPHENE-IMIDAZOPYRIDINES 4SC AG (DE) 2009-01-08 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 (5 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-20100278833-A1 THIOPHENE-IMIDAZOPYRIDINES PIKFYVE, PIP4K2B, PIP5K1B PLK1 642/4885NEK2 2328/4885CSF1R 2699/4885
US-20100279970-A1 METHOD OF REDUCING INTRAOCULAR PRESSURE IN HUMANS PDE6G, NDUFB7, PDE3A PLK1 1914/4885NEK2 1946/4885CSF1R 4066/4885
US-20160158267-A1 METHODS OF PREVENTING, REDUCING OR TREATING MACULAR DEGENERATION ADORA2A, ADORA1, PDE6C PLK1 3599/4885NEK2 2936/4885CSF1R 1908/4885
US-20140275128-A1 METHOD OF PROVIDING OCULAR NEUROPROTECTION ALDH1A2, GAP43, ALDH1A3 PLK1 2895/4885NEK2 1035/4885CSF1R 3725/4885
US-20130217643-A1 METHOD OF REDUCING INTRAOCULAR PRESSURE IN HUMANS PDE6G, NDUFB7, PDE3A PLK1 1914/4885NEK2 1946/4885CSF1R 4066/4885

“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.