SCHEMBL6418376

SCHEMBL6418376

COC(=O)c1cc(C(=O)OC)c2cc[nH]c2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 8/20 0.51
PIM3 Q86V86 2/20 0.50
PIM1 P11309 1/20 0.50
NPC1 O15118 1/20 0.49
CREBBP Q92793 2/20 0.47
KIF11 P52732 1/20 0.44
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
SCHEMBL6871077 0.91 NPC1 (0.47) NR4A2PIM3PIM1NPC1CREBBP
SCHEMBL6418381 0.91 AURKA (0.49) NR4A2PIM3PIM1NPC1CREBBP
SCHEMBL3578888 0.84 LMNA (0.53) NR4A2PIM3PIM1NPC1CREBBP
SCHEMBL3578858 0.84 NPC1 (0.46) NR4A2PIM3PIM1NPC1CREBBP
SCHEMBL2314520 0.84 NR4A2 (0.63) NR4A2PIM3PIM1NPC1CREBBP
SCHEMBL2309361 0.83 NR4A2 (0.64) NR4A2PIM3PIM1CREBBPKDM4E
SCHEMBL1868464 0.83 NR4A2 (0.52) NR4A2PIM3PIM1NPC1CREBBP
SCHEMBL20875014 0.83 NR4A2 (0.46) NR4A2PIM3PIM1NPC1CREBBP
SCHEMBL20692462 0.83 NR4A2 (0.50) NR4A2PIM3PIM1NPC1CREBBP
SCHEMBL12432932 0.83 NR4A2 (0.50) NR4A2PIM3PIM1NPC1CREBBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050178659-A1 Copolymer compound and electrochemical cell therewith NEC TOKIN CORPORATION (JP) 2005-08-18 US disclosed