SCHEMBL29237207

SCHEMBL29237207

OC1CN(c2cccc(I)c2)C1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.43
MGLL Q99685 1/20 0.43
MPI P34949 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NOTUM Q6P988 2/20 0.34
BPTF Q12830 2/20 0.34
SLC18A3 Q16572 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
SOS1 Q07889 1/20 0.33
AR P10275 1/20 0.33
MPO P05164 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HSD11B1 P28845 1/20 0.32

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
SCHEMBL30967878 1.00 FAAH (0.43) FAAHMGLLMPIMEN1KMT2A
SCHEMBL31441994 0.86 AR (0.48) NOTUMBPTFAR
SCHEMBL31442179 0.86 AR (0.48) NOTUMBPTFAR
SCHEMBL17034093 0.79 NOTUM (0.54) FAAHMGLLMEN1KMT2ANOTUM
SCHEMBL15271896 0.78 ADRA2C (0.52) MEN1KMT2ANOTUMBPTFKDM4E
SCHEMBL21683097 0.77 ALOX5 (0.43) MGLLMEN1KMT2ASLC18A3ALDH1A1
SCHEMBL27964512 0.77 AGXT (0.38) MEN1KMT2ANOTUMBPTFKDM4E
SCHEMBL30967933 0.77 FAAH (0.43) FAAHMGLLMPINOTUMBPTF
SCHEMBL29237479 0.77 FAAH (0.43) FAAHMGLLMPINOTUMBPTF
SCHEMBL14862152 0.75 AKR1C3 (0.41) FAAHMGLLNOTUMBPTFAR

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-118201919-A Indole compounds and methods of use 健赞公司 2024-06-14 CN disclosed