SCHEMBL22797204

SCHEMBL22797204

c1ccc(-c2ccccc2Nc2ccccc2-c2ccccc2-c2ccc3c(c2)C2(c4ccccc4-3)C3CC4CC(C3)CC2C4)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SIGMAR1 Q99720 1/20 0.36
FABP3 P05413 1/20 0.35
FABP4 P15090 1/20 0.35
FABP5 Q01469 1/20 0.35
PDK2 Q15119 3/20 0.33
MYC P01106 1/20 0.31
MAX P61244 1/20 0.31
RARB P10826 1/20 0.30
RARG P13631 1/20 0.30
RXRA P19793 1/20 0.30
CDC25B P30305 1/20 0.30
SMO Q99835 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
SCHEMBL22799520 0.88 PDK2 (0.36) MEN1KMT2ANPSR1SIGMAR1PDK2
SCHEMBL22797206 0.87 PDK2 (0.37) MEN1KMT2ANPSR1SIGMAR1FABP3
SCHEMBL22797350 0.86 MEN1 (0.38) MEN1KMT2ANPSR1SIGMAR1FABP3
SCHEMBL22797234 0.86 MEN1 (0.39) MEN1KMT2ANPSR1SIGMAR1FABP3
SCHEMBL22797177 0.84 MEN1 (0.35) MEN1KMT2ANPSR1SIGMAR1PDK2
SCHEMBL22797207 0.83 SIGMAR1 (0.37) MEN1KMT2ANPSR1SIGMAR1FABP3
SCHEMBL22797589 0.82 MEN1 (0.40) MEN1KMT2ANPSR1SIGMAR1FABP3
SCHEMBL22797353 0.82 PDK2 (0.43) MEN1KMT2ANPSR1SIGMAR1PDK2
SCHEMBL22797214 0.82 MEN1 (0.41) MEN1KMT2ANPSR1SIGMAR1FABP3
SCHEMBL25458068 0.81 MEN1 (0.39) MEN1KMT2ANPSR1SIGMAR1FABP3

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-2020248943-A1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC DEVICE 陕西莱特光电材料股份有限公司 2020-12-17 WO disclosed