SCHEMBL19980056

SCHEMBL19980056

CN[C@H]1CCc2cc(Br)ccc2NC1=O

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 10/20 0.51
BRD4 O60885 1/20 0.46
PYGL P06737 2/20 0.39
PYGM P11217 2/20 0.39
PDPK1 O15530 1/20 0.37
LMNA P02545 1/20 0.37
PKM P14618 1/20 0.37
NQO2 P16083 1/20 0.37
SRD5A1 P18405 1/20 0.36
POLB P06746 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C19 P33261 1/20 0.36
CMA1 P23946 1/20 0.36
AHR P35869 1/20 0.36
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36

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
SCHEMBL3924254 0.82 RIPK1 (0.61) RIPK1PYGLPYGMDDB1CRBN
SCHEMBL4214219 0.82 RIPK1 (0.61) RIPK1PYGLPYGMDDB1CRBN
SCHEMBL1347544 0.81 BRD4 (0.49) RIPK1BRD4LMNAPKMNQO2
SCHEMBL25707308 0.80 RIPK1 (0.47) RIPK1BRD4PYGLPYGMNQO2
SCHEMBL9025583 0.79 PYGL (0.53) RIPK1PYGLPYGMPDPK1
SCHEMBL9025588 0.79 PYGL (0.53) RIPK1PYGLPYGMPDPK1
SCHEMBL3623361 0.79 BRD4 (0.46) RIPK1BRD4LMNAPKMSRD5A1
SCHEMBL12376347 0.78 RIPK1 (0.52) RIPK1PYGLPYGM
SCHEMBL1269024 0.78 RIPK1 (0.52) RIPK1PYGLPYGM
SCHEMBL1269028 0.78 RIPK1 (0.52) RIPK1PYGLPYGM

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-3342771-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-11-25 EP disclosed
EP-3375780-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-06-03 EP disclosed
EP-3342771-A1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GlaxoSmithKline Intellectual Property Development Ltd (GB) 2018-07-04 EP disclosed
EP-2956452-B1 HETEROCYCLIC AMIDES AS KINASE INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2018-03-21 EP disclosed