SCHEMBL22959272

SCHEMBL22959272

COc1ccc(Oc2c(Cl)cc(NC(=O)Cc3cccnc3)cc2Cl)cc1C(C)(C)C

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 10/20 0.75
THRB P10828 5/20 0.75
CDK9 P50750 1/20 0.45
CHEK1 O14757 1/20 0.44
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
HTT P42858 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
CSF1R P07333 1/20 0.42
RET P07949 1/20 0.42
PDGFRB P09619 1/20 0.42
KIT P10721 1/20 0.42
PDGFRA P16234 1/20 0.42
DDR1 Q08345 1/20 0.42
NOD2 Q9HC29 1/20 0.42
THRA P10827 1/20 0.42

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
SCHEMBL22959366 0.88 RORC (0.79) RORCTHRBCDK9CHEK1KMT2A
SCHEMBL22959110 0.86 RORC (1.00) RORCTHRBCDK9CHEK1
SCHEMBL22959321 0.84 RORC (0.73) RORCTHRBCDK9CHEK1KMT2A
SCHEMBL22959270 0.80 RORC (0.77) RORCTHRBKMT2AMEN1MAPT
SCHEMBL22959179 0.80 RORC (0.85) RORCTHRBTHRA
SCHEMBL22959412 0.79 RORC (0.81) RORCTHRBTHRA
SCHEMBL22959350 0.78 RORC (0.82) RORCTHRBTHRA
SCHEMBL22959177 0.78 RORC (0.80) RORCTHRBKMT2AMEN1L3MBTL1
SCHEMBL22959119 0.77 RORC (0.63) RORCTHRBCDK9KMT2AL3MBTL1
SCHEMBL22959117 0.76 RORC (0.62) RORCTHRBCDK9KMT2AMEN1

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-2021026179-A1 AGONISTS OF ROR GAMMAt BRISTOL-MYERS SQUIBB COMPANY (US) 2021-02-11 WO disclosed