SCHEMBL3748378

SCHEMBL3748378

COc1cc(C(=O)c2c(-c3cnn(CC(N)=O)c3)oc3c(F)c(OC)ccc23)cc(OC)c1OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKAB2 O43741 1/20 0.37
ABL1 P00519 1/20 0.37
CSF1R P07333 1/20 0.37
LYN P07948 1/20 0.37
PRKAG1 P54619 1/20 0.37
SIK1 P57059 1/20 0.37
PRKAA1 Q13131 1/20 0.37
SIK2 Q9H0K1 1/20 0.37
SIK3 Q9Y2K2 1/20 0.37
TUBB4A P04350 14/20 0.37
TUBB P07437 14/20 0.37
TUBA3C P0DPH7 14/20 0.37
TUBA1B P68363 14/20 0.37
TUBA4A P68366 14/20 0.37
TUBB4B P68371 14/20 0.37
TUBB3 Q13509 14/20 0.37
TUBB2A Q13885 14/20 0.37
TUBB8 Q3ZCM7 14/20 0.37
TUBA3E Q6PEY2 14/20 0.37
TUBA1A Q71U36 14/20 0.37

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
SCHEMBL3753942 0.90 TUBB4A (0.38) PRKAB2ABL1CSF1RLYNPRKAG1
SCHEMBL3746275 0.86 HDAC1 (0.41) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL14227784 0.86 PRKAB2 (0.38) PRKAB2ABL1CSF1RLYNPRKAG1
SCHEMBL12854889 0.86 TUBB4A (0.41) CSF1RTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL3757755 0.83 TUBB1 (0.49) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL14227782 0.80 PRKAB2 (0.38) PRKAB2ABL1CSF1RLYNPRKAG1
SCHEMBL12854876 0.78 HSP90AB1 (0.36) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL3748354 0.78 TUBB1 (0.54) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL3749411 0.77 TUBB4A (0.41) CSF1RTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL12854869 0.77 KLKB1 (0.40) TUBB4ATUBBTUBA3CTUBA1BTUBA4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8557982-B2 Tubulin polymerisation inhibitors BIONOMICS LIMITED (AU) 2013-10-15 US claimed
US-20120309768-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS BIONOMICS LIMITED (AU) 2012-12-06 US claimed
US-8278290-B2 Tubulin polymerisation inhibitors Biononics Limited (AU) 2012-10-02 US claimed
US-20100292190-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS BIONOMICS LIMITED (AU) 2010-11-18 US claimed
US-8557982-B2 Tubulin polymerisation inhibitors BIONOMICS LIMITED (AU) 2013-10-15 US disclosed
US-8557982-B2 Tubulin polymerisation inhibitors BIONOMICS LIMITED (AU) 2013-10-15 US disclosed
US-20120309768-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS BIONOMICS LIMITED (AU) 2012-12-06 US disclosed
US-20120309768-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS BIONOMICS LIMITED (AU) 2012-12-06 US disclosed
US-8278290-B2 Tubulin polymerisation inhibitors Biononics Limited (AU) 2012-10-02 US disclosed
US-8278290-B2 Tubulin polymerisation inhibitors Biononics Limited (AU) 2012-10-02 US disclosed
US-8278290-B2 Tubulin polymerisation inhibitors Biononics Limited (AU) 2012-10-02 US disclosed
US-20100292190-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS BIONOMICS LIMITED (AU) 2010-11-18 US disclosed
US-20100292190-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS BIONOMICS LIMITED (AU) 2010-11-18 US disclosed
US-20100292190-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS BIONOMICS LIMITED (AU) 2010-11-18 US disclosed
EP-1848704-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS Bionomics Limited (AU) 2007-10-31 EP disclosed
WO-2006084338-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS BIONOMICS LIMITED (AU) 2006-08-17 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-20100292190-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS TUBB1, TUBA1C, TUBB PRKAB2 2401/4885ABL1 984/4885CSF1R 2715/4885
US-20120309768-A1 NOVEL TUBULIN POLYMERISATION INHIBITORS TUBB1, TUBA1C, TUBB PRKAB2 2401/4885ABL1 984/4885CSF1R 2715/4885

“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.