SCHEMBL28487705

SCHEMBL28487705

Cc1cc2cc(F)cc(C)c2[nH]1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.35
GAA P10253 3/20 0.34
KMT2A Q03164 3/20 0.34
HTT P42858 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
POLB P06746 2/20 0.33
RXFP1 Q9HBX9 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GRIN2D O15399 2/20 0.33
GRIN3B O60391 2/20 0.33
GRIN1 Q05586 2/20 0.33
GRIN2A Q12879 2/20 0.33
GRIN2B Q13224 2/20 0.33
GRIN2C Q14957 2/20 0.33
GRIN3A Q8TCU5 2/20 0.33
MAPT P10636 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 2/20 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
SCHEMBL1757449 0.82 HRH4 (0.41) KDM4EGAAHTTSMN1; SMN2TDP1
SCHEMBL24629725 0.79 KMT2A (0.52) KDM4EGAAKMT2AHTTSMN1; SMN2
SCHEMBL7006443 0.78 XDH (0.37) KMT2APOLBRXFP1MEN1NPC1
SCHEMBL1757881 0.78 HRH4 (0.32) ARKEAP1NFE2L2CYP2A6
SCHEMBL12970315 0.77 GRIN2D (0.47) KDM4EGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL14115020 0.76 HRH4 (0.45) KDM4EGAAKMT2AHTTSMN1; SMN2
SCHEMBL23685896 0.75 EIF4A3 (0.34)
SCHEMBL1757914 0.72 MAPK1 (0.37) KDM4EGAAKMT2AL3MBTL1KEAP1
SCHEMBL3361286 0.72 DAO (0.60) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL14115029 0.72 AXL (0.52) HTTALDH1A1PTGS1PTGS2CYP2A6

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112047870-B Preparation method of 7-alkyl indole derivative 浙江工业大学 2021-10-12 CN disclosed
CN-112047870-A Preparation method of 7-alkyl indole derivative 浙江工业大学 2020-12-08 CN disclosed