SCHEMBL30468720

SCHEMBL30468720

O=C(O)Cc1cc2c(Cl)cccc2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 3/20 0.51
AKR1B1 P15121 1/20 0.49
FLT3 P36888 2/20 0.45
HRH4 Q9H3N8 1/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44
HSD17B10 Q99714 1/20 0.44
GPR17 Q13304 1/20 0.43
RHEB Q15382 1/20 0.43
GAA P10253 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43

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
SCHEMBL1439650 1.00 DAO (0.51) DAOAKR1B1FLT3HRH4KDM4E
SCHEMBL9534359 0.82 KDM4E (0.46) DAOAKR1B1HRH4KDM4EALDH1A1
SCHEMBL152992 0.82 MTNR1A (0.47) DAOFLT3HRH4KDM4EALDH1A1
SCHEMBL28577623 0.81 FLT3 (0.45) FLT3HRH4KDM4EALDH1A1MAPT
SCHEMBL10824679 0.81 KDM4E (0.44) AKR1B1KDM4EALDH1A1MAPTMEN1
SCHEMBL5694485 0.81 PBRM1 (0.45) KDM4EALDH1A1MAPTMEN1HPGD
SCHEMBL28589699 0.81 DAO (0.51) DAOFLT3KDM4EALDH1A1MAPT
SCHEMBL4561870 0.80 RHEB (0.57) DAOFLT3HRH4RHEB
SCHEMBL4979042 0.79 DAO (0.51) DAOFLT3HRH4RHEB
SCHEMBL2648755 0.78 KDM4E (0.41) AKR1B1KDM4EALDH1A1MAPTMEN1

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
WO-2023110673-A1 PHOSPHODIESTERASES INHIBITORS TO PROMOTE IN VITRO PLANT CELL REPROGRAMMING TOWARDS PLANT EMBRYOGENESIS OR MICROCALLUS FORMATION CONSEJO SUPERIOR DE INVESTIGACIONES CIENTIFICAS (CSIC) (ES) 2023-06-22 WO disclosed