SCHEMBL22600910

SCHEMBL22600910

CC1(C)c2ccccc2-c2ccc(-c3ccc(N4c5ccccc5Oc5ccccc54)cc3)cc21

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PGR P06401 8/20 0.37
PDK2 Q15119 10/20 0.36
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPC1 O15118 1/20 0.33
USP2 O75604 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL22600945 0.96 PDK2 (0.33) PGRPDK2MAPTSMN1; SMN2
SCHEMBL21868563 0.91 PDK2 (0.34) PGRPDK2MEN1KMT2ANPC1
SCHEMBL10134247 0.91 P2RX4 (0.32) PDK2MEN1KMT2ANPC1USP2
SCHEMBL22600944 0.90 PGR (0.41) PGRPDK2MEN1KMT2A
SCHEMBL18544766 0.90 PDK2 (0.40) PGRPDK2
SCHEMBL17278532 0.89 PGR (0.34) PGRPDK2MEN1KMT2ANPC1
SCHEMBL20931571 0.89 PGR (0.34) PGRMEN1KMT2ANPC1USP2
SCHEMBL17278523 0.89 PGR (0.34) PGRPDK2MEN1KMT2ANPC1
SCHEMBL24062410 0.89 PGR (0.38) PGRPDK2MEN1KMT2ANPC1
SCHEMBL22600933 0.89 PGR (0.40) PGRPDK2MEN1KMT2A

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