SCHEMBL29026237

SCHEMBL29026237

Oc1ccc2ccccc2c1-c1c(O)c(-c2ccccc2)cc2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.52
KMT2A Q03164 5/20 0.52
MAPT P10636 2/20 0.52
ESR1 P03372 1/20 0.49
ESR2 Q92731 1/20 0.49
KDM4E B2RXH2 3/20 0.49
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49
MPI P34949 1/20 0.49
GPR84 Q9NQS5 3/20 0.48
HSD17B1 P14061 3/20 0.48
HSD17B2 P37059 3/20 0.48
CYP1A2 P05177 2/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2D6 P10635 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2B6 P20813 2/20 0.48
CYP2C19 P33261 2/20 0.48
ALOX5 P09917 1/20 0.47
PTPN22 Q9Y2R2 1/20 0.47

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
SCHEMBL13860948 0.92 MEN1 (0.49) MEN1KMT2AMAPTESR1ESR2
SCHEMBL12786263 0.91 MEN1 (0.48) MEN1KMT2AMAPTESR1ESR2
SCHEMBL29510114 0.90 MEN1 (0.58) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL30275493 0.90 MEN1 (0.58) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL3262604 0.90 MEN1 (0.58) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL2533194 0.84 MEN1 (0.56) MEN1KMT2AMAPTESR1ESR2
SCHEMBL4255791 0.84 MEN1 (0.52) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL15274958 0.83 HSD17B1 (0.43) MEN1KMT2AMAPTESR1ESR2
SCHEMBL7628168 0.83 PTPN22 (0.48) MEN1KMT2AMAPTESR1ESR2
SCHEMBL2528988 0.82 MEN1 (0.54) MEN1KMT2AMAPTKDM4EALDH1A1

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-116348435-A Process for preparing dimeric phosphazene-derived bronsted acids 科勒研究非盈利有限责任公司 2023-06-27 CN disclosed