SCHEMBL38656167

SCHEMBL38656167

Fc1ccccc1-c1cnco1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.48
NOTUM Q6P988 2/20 0.47
CYP11B1 P15538 1/20 0.44
CYP11B2 P19099 1/20 0.44
PTK2 Q05397 1/20 0.44
ADRA1A P35348 2/20 0.43
IMPDH2 P12268 3/20 0.42
IMPDH1 P20839 2/20 0.42
HDAC4 P56524 1/20 0.42
GAA P10253 1/20 0.41
LMNA P02545 1/20 0.41
PKM P14618 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
MAP4K4 O95819 1/20 0.41
ADRA1D P25100 1/20 0.40
ADRA1B P35368 1/20 0.40
ATR Q13535 1/20 0.40
AAK1 Q2M2I8 1/20 0.39

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
SCHEMBL9955245 1.00 PDK2 (0.48) PDK2NOTUMCYP11B1CYP11B2PTK2
SCHEMBL2898683 0.93 PDK2 (0.47) PDK2NOTUMCYP11B1CYP11B2PTK2
SCHEMBL29541692 0.77 IMPDH2 (0.49) PDK2NOTUMCYP11B1CYP11B2PTK2
SCHEMBL26259988 0.77 MEN1 (0.48) PDK2NOTUMCYP11B1CYP11B2PTK2
SCHEMBL26259975 0.77 CYP11B1 (0.48) PDK2NOTUMCYP11B1CYP11B2PTK2
SCHEMBL30570522 0.76 MAP4K4 (0.49) PDK2NOTUMCYP11B1CYP11B2PTK2
SCHEMBL4457202 0.76 MAP4K4 (0.49) PDK2NOTUMCYP11B1CYP11B2PTK2
SCHEMBL1363022 0.76 NOTUM (0.50) PDK2NOTUMCYP11B1CYP11B2PTK2
SCHEMBL1903692 0.76 PDK2 (0.48) PDK2NOTUMCYP11B1CYP11B2PTK2
SCHEMBL1328549 0.76 GAA (0.50) PDK2NOTUMCYP11B1CYP11B2PTK2

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
EP-3829559-B1 INHIBITORS OF HISTONE DEACETYLASE USEFUL FOR THE TREATMENT OR PREVENTION OF HIV INFECTION MERCK SHARP & DOHME LLC (US) 2026-05-13 EP disclosed