SCHEMBL4417419

SCHEMBL4417419

CC(=O)c1cccc(C(=O)Nc2ccc(C)c(-c3cc(C(=O)NCC(C)(C)C)on3)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.48
HTT P42858 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KMT2A Q03164 1/20 0.43
RAF1 P04049 17/20 0.42
BRAF P15056 17/20 0.42
RAC1 P63000 1/20 0.40

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
SCHEMBL4565727 0.91 NR1H4 (0.48) RAF1BRAF
SCHEMBL4408307 0.91 RAF1 (0.42) GLAHTTL3MBTL1RAF1BRAF
SCHEMBL4565699 0.91 BRAF (0.45) KMT2ARAF1BRAF
SCHEMBL4551203 0.91 CYP1A2 (0.45) RAF1BRAF
SCHEMBL4565940 0.90 FFAR1 (0.46) KMT2ARAF1BRAF
SCHEMBL4565578 0.90 RAF1 (0.46) RAF1BRAF
SCHEMBL4412586 0.89 RAF1 (0.46) RAF1BRAF
SCHEMBL4413519 0.89 HSP90AA1 (0.49) KMT2ARAF1BRAFRAC1
SCHEMBL4565554 0.89 BRAF (0.47) RAF1BRAF
SCHEMBL4407858 0.89 RAF1 (0.55) RAF1BRAF

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 3 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