SCHEMBL11463147

SCHEMBL11463147

COc1ccc(-c2cn(N(C)CCN(C)C)c3ccccc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 5/20 0.46
▸ SMPD1 P17405 3/20 0.41
▸ GRIK2 Q13002 1/20 0.40
▸ PAX8 Q06710 1/20 0.40
▸ TSPO P30536 1/20 0.38
▸ PLK4 O00444 1/20 0.38
▸ NUAK1 O60285 1/20 0.38
▸ SRC P12931 1/20 0.38
▸ FLT4 P35916 1/20 0.38
▸ KDR P35968 1/20 0.38
▸ FLT3 P36888 1/20 0.38
▸ TEK Q02763 1/20 0.38
▸ POLB P06746 2/20 0.38
▸ RAD52 P43351 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ RAB9A P51151 1/20 0.37

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
Binedaline SCHEMBL49440 0.86 L3MBTL1 (0.42) HTR6KDR
Binedaline SCHEMBL5957158 0.85 L3MBTL1 (0.41) HTR6KDRHTT
SCHEMBL11452382 0.79 L3MBTL1 (0.40) HTR6KDRKDM4E
SCHEMBL11452293 0.75 L3MBTL1 (0.39) HTR6POLBRAD52GAARAB9A
SCHEMBL7549158 0.69 KDR (0.69) HTR6FLT4KDRFLT3
SCHEMBL11464649 0.68 HTR6 (0.46) HTR6KDM4EALDH1A1HTTRAB9A
SCHEMBL11399845 0.68 DNM2 (0.42) POLBKDM4EALDH1A1
SCHEMBL11465337 0.65 RXRA (0.41) HTR6TSPOSRCFLT3KDM4E
SCHEMBL28984412 0.65 L3MBTL1 (0.77) HTR6KDM4E
SCHEMBL11461068 0.65 CSF1R (0.39) HTR6KDM4EALDH1A1

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
US-4204998-A N-Amino indole derivatives having pharmacological activity SIEGFRIED AKTIENGESELLSCHAFT (CH) 1980-05-27 — — US claimed
US-4204998-A N-Amino indole derivatives having pharmacological activity SIEGFRIED AKTIENGESELLSCHAFT (CH) 1980-05-27 — — US disclosed
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