SCHEMBL22600796

SCHEMBL22600796

CC1(C)c2cc(-c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)ccc2-c2ccc(-c3ccc(N4c5ccccc5C(C)(C)c5ccccc54)cc3)cc21

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 13/20 0.38
PGR P06401 6/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL22600933 0.97 PGR (0.40) PDK2PGRKMT2A
SCHEMBL2604409 0.94 PDK2 (0.37) PDK2PGRCYP1A2CYP2D6KMT2A
SCHEMBL22600944 0.92 PGR (0.41) PDK2PGRKMT2A
SCHEMBL13827537 0.92 PDK2 (0.42) PDK2PGRKMT2A
SCHEMBL15183777 0.91 PDK2 (0.38) PDK2PGR
SCHEMBL19368063 0.91 PGR (0.36) PDK2PGRKMT2A
SCHEMBL22600792 0.90 PGR (0.46) PDK2PGRKMT2A
SCHEMBL13231563 0.88 KMT2A (0.41) PGRCYP1A2CYP2D6KMT2A
SCHEMBL15469331 0.88 PDK2 (0.43) PDK2PGR
SCHEMBL13827555 0.88 PDK2 (0.43) PDK2PGR

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
US-20200343453-A1 LIGHT-EMITTING MATERIAL, ORGANIC LIGHT-EMITTING ELEMENT, AND COMPOUND Kyushu University, University Corporation (JP) 2020-10-29 US disclosed