SCHEMBL29930304

SCHEMBL29930304

O=C1c2ccccc2-n2c1cc1c(F)cccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 2/20 0.40
IDO2 Q6ZQW0 2/20 0.40
MAPT P10636 5/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 5/20 0.38
MEN1 O00255 4/20 0.38
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 2/20 0.38
USP2 O75604 1/20 0.38
HPGD P15428 1/20 0.38
TNNI3 P19429 1/20 0.38
CASP1 P29466 1/20 0.38
BRCA1 P38398 1/20 0.38
TNNT2 P45379 1/20 0.38
CASP7 P55210 1/20 0.38
TNNC1 P63316 1/20 0.38
IDO1 P14902 2/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL28894228 1.00 TDO2 (0.40) TDO2IDO2MAPTNPC1RAB9A
SCHEMBL154089 0.83 MAPK14 (0.47) TDO2IDO2MAPTNPC1RAB9A
SCHEMBL29929589 0.82 MAPT (0.45) TDO2IDO2MAPTNPC1RAB9A
SCHEMBL28894034 0.82 MAPK14 (0.44) TDO2IDO2MAPTNPC1RAB9A
SCHEMBL153851 0.82 KDM4E (0.44) TDO2IDO2MAPTNPC1RAB9A
SCHEMBL29930134 0.82 MAPT (0.39) TDO2IDO2MAPTNPC1RAB9A
SCHEMBL29930255 0.82 MAPK14 (0.44) TDO2IDO2MAPTNPC1RAB9A
SCHEMBL157234 0.82 MAPT (0.45) TDO2IDO2MAPTNPC1RAB9A
SCHEMBL28894135 0.82 MAPT (0.39) TDO2IDO2MAPTNPC1RAB9A
SCHEMBL143394 0.78 TNFRSF1A (0.46) MAPTNPC1RAB9AMAPK1KMT2A

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-115043847-B Preparation method of 10H-indolo [1,2-a ] indol-10-one compound 西北师范大学 2023-05-26 CN disclosed
CN-115043847-A Preparation method of 10H-indolo [1,2-a ] indol-10-one compound 西北师范大学 2022-09-13 CN disclosed