SCHEMBL9942599

SCHEMBL9942599

Bc1ncc(Cl)c2cc[nH]c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 2/20 0.41
PRKCI P41743 2/20 0.41
AHR P35869 1/20 0.39
DYRK1A Q13627 2/20 0.37
CCR8 P51685 1/20 0.34
KMT2A Q03164 1/20 0.33
CCNK O75909 1/20 0.33
CDK12 Q9NYV4 1/20 0.33
JAK2 O60674 2/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
TTBK1 Q5TCY1 2/20 0.32
TTBK2 Q6IQ55 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.32
MAPT P10636 1/20 0.32
RHEB Q15382 1/20 0.31
AURKA O14965 1/20 0.30
DAPK3 O43293 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
SCHEMBL12491412 0.82 DYRK1A (0.47) AXLPRKCIAHRDYRK1ACCR8
SCHEMBL2628940 0.78 PRKCI (0.40) AXLPRKCIAHRDYRK1ACCR8
SCHEMBL10069068 0.76 NUDT1 (0.38) AXLPRKCIDYRK1ACCR8JAK2
SCHEMBL16046354 0.74 AXL (0.41) AXLPRKCIAHRDYRK1ACCNK
SCHEMBL12491288 0.73 PRKCI (0.42) AXLPRKCIAHRDYRK1ACCR8
SCHEMBL10326422 0.72 ABL1 (0.37) AXLPRKCIJAK2JAK1TYK2
SCHEMBL9942629 0.71 DYRK1A (0.44) AXLPRKCIAHRDYRK1ACCR8
SCHEMBL26145364 0.71 AXL (0.44) AXLPRKCIAHRDYRK1ACCR8
SCHEMBL20577529 0.71 PRKCI (0.40) AXLPRKCIAHRDYRK1ACCR8
SCHEMBL31000812 0.71 PRKCI (0.40) AXLPRKCIAHRDYRK1ACCR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1363705-B9 COMPOSITION AND ANTIVIRAL ACTIVITY OF SUBSTITUTED AZAINDOLEOXOACETIC PIPERAZINE DERIVATIVES BRISTOL MYERS SQUIBB CO (US) 2012-11-07 EP disclosed
EP-1363705-B1 COMPOSITION AND ANTIVIRAL ACTIVITY OF SUBSTITUTED AZAINDOLEOXOACETIC PIPERAZINE DERIVATIVES BRISTOL MYERS SQUIBB CO (US) 2012-06-13 EP disclosed