SCHEMBL5263472

SCHEMBL5263472

CCOC(=O)c1ccc(C(F)(F)F)nc1C.CCOC(=O)c1ccc(C(F)(F)F)nc1C(F)(F)F.COC(=O)c1ccc(C(F)(F)F)nc1C(F)(F)F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.49
LMNA P02545 1/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
NPSR1 Q6W5P4 1/20 0.45
GAA P10253 3/20 0.45
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44
TUBB3 Q13509 1/20 0.44
TUBB2A Q13885 1/20 0.44
TUBB8 Q3ZCM7 1/20 0.44
TUBA3E Q6PEY2 1/20 0.44
TUBA1A Q71U36 1/20 0.44
TUBA1C Q9BQE3 1/20 0.44
TUBB6 Q9BUF5 1/20 0.44
TUBB2B Q9BVA1 1/20 0.44

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
SCHEMBL5317857 0.95 KDM4E (0.53) KDM4ELMNANPC1RAB9ANPSR1
SCHEMBL4192553 0.90 KDM4E (0.58) KDM4ELMNANPC1RAB9ANPSR1
SCHEMBL1498542 0.88 KDM4E (0.50) KDM4ELMNANPC1RAB9ANPSR1
SCHEMBL31697314 0.88 KDM4E (0.50) KDM4ELMNANPC1RAB9ANPSR1
SCHEMBL4195184 0.85 LMNA (0.55) LMNANPC1RAB9AGAATUBB4A
SCHEMBL10667889 0.85 TUBB4A (0.54) KDM4ELMNANPC1RAB9ANPSR1
SCHEMBL5262306 0.80 TUBB4A (0.50) KDM4ELMNANPC1RAB9AGAA
SCHEMBL5264347 0.79 TUBB4A (0.45) KDM4ELMNANPSR1TUBB4ATUBB
SCHEMBL6377043 0.77 KDM4E (0.59) KDM4ENPSR1MAPTIDO1ALDH1A1
SCHEMBL3995268 0.77 KDM4E (0.53) KDM4ELMNANPC1RAB9ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1824828-A2 PYRIDINE BASED COMPOUNDS USEFUL AS INTERMEDIATES FOR PHARMACEUTICAL OR AGRICULTURAL END-PRODUCTS Peakdale Molecular Limited (GB) 2007-08-29 EP claimed
WO-2006059103-A2 PYRIDINE BASED COMPOUNDS USEFUL AS INTERMEDIATES FOR PHARMACEUTICAL OR AGRICULTURAL END-PRODUCTS PEAKDALE MOLECULAR LIMITED (GB) 2006-06-08 WO claimed