SCHEMBL20804451

SCHEMBL20804451

Cc1nn(C(=O)OC(C)(C)C)c2cc(Br)c(Cl)cc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.35
MAP2K4 P45985 1/20 0.34
SLC22A12 Q96S37 1/20 0.33
ROCK2 O75116 1/20 0.32
CHEK2 O96017 1/20 0.32
PRKACA P17612 1/20 0.32
RPS6KA3 P51812 1/20 0.32
PAK1 Q13153 1/20 0.32
ROCK1 Q13464 1/20 0.32
DYRK1A Q13627 1/20 0.32
PRKD2 Q9BZL6 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ELANE P08246 2/20 0.32
LMNA P02545 1/20 0.31
RHEB Q15382 1/20 0.31
KCNH2 Q12809 1/20 0.31
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
MAPT P10636 1/20 0.30

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
SCHEMBL20804449 0.86 FAAH (0.34) FAAHMAP2K4ROCK2CHEK2PRKACA
SCHEMBL30316429 0.82 MAP2K4 (0.36) FAAHMAP2K4ELANELMNAGABRG2
SCHEMBL931118 0.79 ELANE (0.43) MAP2K4ELANEGABRG2GABRB3GABRA5
SCHEMBL11232 0.79 PDGFRA (0.47) MAP2K4SLC22A12ELANE
SCHEMBL24933928 0.78 GABRG2 (0.37) FAAHMAP2K4SLC22A12KMT2AELANE
SCHEMBL14688976 0.78 GABRG2 (0.37) FAAHMAP2K4ELANEGABRG2GABRB3
SCHEMBL20804312 0.78 AXL (0.46) MAP2K4AURKACDK2
SCHEMBL26977231 0.77 MAP2K4 (0.34) FAAHMAP2K4ROCK2CHEK2PRKACA
SCHEMBL832980 0.76 MAP2K4 (0.38) FAAHMAP2K4ELANEGABRG2GABRB3
SCHEMBL7605898 0.76 ELANE (0.44) FAAHMAP2K4SLC22A12ELANELMNA

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
WO-2019051199-A1 6-CYANO-INDAZOLE COMPOUNDS AS HEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) MODULATORS INCYTE CORPORATION (US) 2019-03-14 WO disclosed