SCHEMBL27916148

SCHEMBL27916148

Brc1cccc(-c2ccc(-c3cccc4c3[nH]c3ccccc34)cc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDO2 P48775 4/20 0.60
▸ IDO1 P14902 2/20 0.60
▸ AR P10275 1/20 0.44
▸ KIF11 P52732 1/20 0.44
▸ HTR6 P50406 1/20 0.43
▸ CDK4 P11802 6/20 0.43
▸ CCND1 P24385 6/20 0.43
▸ CCNB2 O95067 1/20 0.43
▸ CCNE2 O96020 1/20 0.43
▸ CDK1 P06493 1/20 0.43
▸ CCNB1 P14635 1/20 0.43
▸ CCNE1 P24864 1/20 0.43
▸ CDK2 P24941 1/20 0.43
▸ CCNB3 Q8WWL7 1/20 0.43
▸ CAMK2D Q13557 1/20 0.42
▸ PARP14 Q460N5 4/20 0.42
▸ HPGD P15428 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL1193029 0.94 TDO2 (0.63) TDO2IDO1ARKIF11HTR6
SCHEMBL28098173 0.93 TDO2 (0.59) TDO2IDO1ARKIF11HTR6
SCHEMBL788300 0.87 KIF11 (0.49) TDO2IDO1ARKIF11CDK4
SCHEMBL28261376 0.87 KIF11 (0.49) TDO2IDO1ARKIF11CDK4
SCHEMBL30463516 0.87 KIF11 (0.49) TDO2IDO1ARKIF11CDK4
SCHEMBL5457562 0.87 IDO1 (0.49) TDO2IDO1ARKIF11CDK4
SCHEMBL5929597 0.86 IDO1 (0.54) TDO2IDO1ARKIF11PARP14
SCHEMBL30985274 0.85 CDK4 (0.54) TDO2KIF11CDK4CCND1CCNB2
SCHEMBL30985273 0.85 CDK4 (0.54) TDO2KIF11CDK4CCND1CCNB2
SCHEMBL17969001 0.85 CDK4 (0.54) TDO2KIF11CDK4CCND1CCNB2

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
CN-103242339-A Heterocyclic compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO LTD 2013-08-14 — — CN disclosed
Send feedback