SCHEMBL4565699

SCHEMBL4565699

Cc1ccc(NC(=O)c2cccc(Cl)c2)cc1-c1cc(C(=O)NCC(C)(C)C)on1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 3/20 0.45
MAPK13 O15264 1/20 0.45
KDR P35968 1/20 0.45
MAPK12 P53778 1/20 0.45
MAPK11 Q15759 1/20 0.45
MAPK14 Q16539 1/20 0.45
MAPT P10636 2/20 0.44
RXFP1 Q9HBX9 1/20 0.44
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
KCNK3 O14649 2/20 0.44
KCNK9 Q9NPC2 2/20 0.44
TAS2R8 Q9NYW2 1/20 0.43
CSF1R P07333 1/20 0.43
SMO Q99835 1/20 0.43
RAF1 P04049 1/20 0.43
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43

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
SCHEMBL4417419 0.91 GLA (0.48) BRAFRAF1KMT2A
SCHEMBL4408307 0.89 RAF1 (0.42) BRAFRAF1
SCHEMBL4565727 0.89 NR1H4 (0.48) BRAFMAPK13KDRMAPK12MAPK11
SCHEMBL4551203 0.89 CYP1A2 (0.45) BRAFMAPTKCNK3KCNK9RAF1
SCHEMBL4565940 0.88 FFAR1 (0.46) BRAFMAPK14RAF1NPC1HPGD
SCHEMBL4565578 0.88 RAF1 (0.46) BRAFRAF1
SCHEMBL4407858 0.88 RAF1 (0.55) BRAFRAF1
SCHEMBL4413519 0.88 HSP90AA1 (0.49) BRAFMAPTKCNK3KCNK9RAF1
SCHEMBL4565554 0.88 BRAF (0.47) BRAFKDRRAF1
SCHEMBL4412713 0.87 BRAF (0.47) BRAFMAPK14CNR1TAS2R8RAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2035005-A2 THERAPY USING CYTOKINE INHIBITORS Kemia, INC. (US) 2009-03-18 EP disclosed
WO-2007146712-A2 THERAPY USING CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-12-21 WO disclosed
WO-2007075896-A2 HETEROCYCLIC CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-07-05 WO disclosed
WO-2007075896-A2 HETEROCYCLIC CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-07-05 WO disclosed