SCHEMBL30901161

SCHEMBL30901161

Oc1ccc2c(c1)C(c1ccccc1)c1cc(O)ccc1-2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 1/20 0.54
ALOX5 P09917 1/20 0.47
CYP19A1 P11511 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
PSMB5 P28074 1/20 0.42
ESR2 Q92731 4/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 2/20 0.42
HSD17B10 Q99714 2/20 0.42
MAPK1 P28482 2/20 0.42
TSHR P16473 1/20 0.42
DRD1 P21728 5/20 0.41
DRD2 P14416 2/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
CDK5 Q00535 1/20 0.41
CDK5R1 Q15078 1/20 0.41

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
SCHEMBL29242486 1.00 DYRK1A (0.54) DYRK1AALOX5CYP19A1MAOAMAOB
SCHEMBL4400536 0.94 DYRK1A (0.48) DYRK1AALOX5CYP19A1MAOAMAOB
SCHEMBL5030661 0.79 ALDH1A1 (0.56) CYP19A1MAOAMAOBPSMB5ESR2
SCHEMBL4417137 0.77 ESR2 (0.43) DYRK1AALOX5ESR2MEN1KMT2A
SCHEMBL25107270 0.75 LMNA (0.42) DYRK1AALOX5MAOAMAOBMEN1
SCHEMBL14701534 0.75 MEN1 (0.42) DYRK1ACYP19A1MEN1KMT2AALDH1A1
SCHEMBL19851151 0.75 MEN1 (0.64) CYP19A1MAOAMAOBPSMB5ESR2
SCHEMBL29496707 0.74 MEN1 (0.47) ALOX5ESR2MEN1KMT2AKDM4E
SCHEMBL918436 0.74 KMT2A (0.61) DYRK1AESR2MEN1KMT2AKDM4E
SCHEMBL4418128 0.74 ESR2 (0.63) ALOX5ESR2MEN1KMT2AALDH1A1

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-117986567-A Hyperbranched polyaryletherketone and preparation method and application thereof 中国科学院成都有机化学有限公司 2024-05-07 CN disclosed