SCHEMBL27697283

SCHEMBL27697283

CCC(=O)OC(C)c1cn(Cc2cccc(F)c2)c2ccc(F)cc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.45
ALDH1A1 P00352 5/20 0.44
TDP1 Q9NUW8 3/20 0.44
LMNA P02545 3/20 0.44
GAA P10253 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CYP19A1 P11511 1/20 0.43
MAPK1 P28482 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
ICMT O60725 1/20 0.40
POLB P06746 1/20 0.40
ALPG P10696 1/20 0.40
DNMT1 P26358 1/20 0.40
DUSP3 P51452 1/20 0.40
CASP6 P55212 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL27729418 0.82 LMNA (0.52) ALDH1A1TDP1LMNAGAASMN1; SMN2
SCHEMBL27751837 0.68 CYP19A1 (0.41) THRBALDH1A1TDP1LMNAGAA
SCHEMBL25021463 0.68 ANPEP (0.44) TSHR
Hydrochloric Acid SCHEMBL27533449 0.68 HDAC4 (0.43) LMNAMEN1KMT2A
SCHEMBL22474196 0.67 PPARG (0.50) MEN1KMT2APOLB
SCHEMBL21850401 0.67 SLC1A1 (0.45) LMNAMEN1KMT2A
SCHEMBL13131368 0.67 ALDH1A1 (0.66) ALDH1A1TDP1LMNAGAASMN1; SMN2
SCHEMBL27919840 0.67 CYP19A1 (0.46) THRBALDH1A1CYP19A1ICMT
SCHEMBL27458167 0.67 ALDH1A1 (0.58) ALDH1A1LMNASMN1; SMN2MAPK1L3MBTL1
SCHEMBL9737535 0.66 MAPT (0.57) TDP1PTGDR2MAPTTSHR

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-101010297-B N- (1H-indolyl) -1H-indole-2-carboxamide derivatives, their preparation and their pharmaceutical use SANOFI AVENTIS 2011-07-27 CN disclosed
CN-101010297-A N- (1H-indolyl) -1H-indole-2-carboxamide derivatives, their preparation and their pharmaceutical use SANOFI AVENTIS (FR) 2007-08-01 CN disclosed