SCHEMBL20352857

SCHEMBL20352857

Cn1c(C(C)(C)C)c(-c2ccc(Br)cc2)c2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 0.42
▸ BCHE P06276 1/20 0.42
▸ GPR3 P46089 1/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ LMNA P02545 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ MAPK14 Q16539 1/20 0.41
▸ MAPT P10636 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ MEN1 O00255 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.36
▸ THRB P10828 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ CDK4 P11802 1/20 0.36
▸ CCND1 P24385 1/20 0.36
▸ CAMK2B Q13554 1/20 0.36
▸ CAMK2G Q13555 1/20 0.36
▸ CAMK2D Q13557 1/20 0.36

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
SCHEMBL20353050 0.80 KMT2A (0.43) GPR3KMT2ALMNASMN1; SMN2MAPK14
SCHEMBL20353054 0.80 KMT2A (0.43) GPR3KMT2ALMNASMN1; SMN2MAPK14
SCHEMBL28624996 0.76 GPR3 (0.50) ACHEBCHEGPR3KMT2ALMNA
SCHEMBL17883125 0.76 ALDH1A1 (0.50) ACHEBCHEGPR3KMT2ALMNA
SCHEMBL17883127 0.76 L3MBTL1 (0.53) ACHEBCHEGPR3KMT2ALMNA
SCHEMBL20352888 0.72 KMT2A (0.37) KMT2ALMNASMN1; SMN2MAPK14GAA
SCHEMBL20352887 0.71 PPARG (0.38) KMT2ALMNASMN1; SMN2MAPK14KDM4E
SCHEMBL15260123 0.71 CDK4 (0.48) ACHEBCHEGPR3KMT2ALMNA
SCHEMBL13542540 0.71 GPR3 (0.52) GPR3KMT2ALMNASMN1; SMN2MAPT
SCHEMBL14948211 0.69 MAPK1 (0.41) ACHESMN1; SMN2MAPTHTTNPSR1

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-2018119729-A1 ORGANIC COMPOUND AND ELECTRONIC DEVICE COMPRISING AN ORGANIC LAYER COMPRISING THE ORGANIC COMPOUND DOW GLOBAL TECHNOLOGIES LLC (US) 2018-07-05 — — WO disclosed
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