SCHEMBL28208757

SCHEMBL28208757

Cc1c(C(=O)c2ccccc2)oc2cc(OCc3ccccc3)ccc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.66
ACHE P22303 5/20 0.66
MAOA P21397 4/20 0.61
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
KDM4E B2RXH2 2/20 0.60
ALDH1A1 P00352 2/20 0.60
TDP1 Q9NUW8 3/20 0.58
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
CASP3 P42574 2/20 0.58
SENP8 Q96LD8 2/20 0.58
SENP7 Q9BQF6 2/20 0.58
SENP6 Q9GZR1 2/20 0.58
POLB P06746 1/20 0.55
HPGD P15428 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
TUBB4A P04350 1/20 0.52
TUBB P07437 1/20 0.52
TUBA3C P0DPH7 1/20 0.52

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
SCHEMBL8550306 0.94 MAOB (0.62) MAOBACHEMAOAMEN1KMT2A
SCHEMBL28209630 0.91 CASP3 (0.61) MAOBACHEMEN1KMT2AKDM4E
SCHEMBL28411136 0.85 CASP3 (0.57) MAOBACHEMAOAMEN1KMT2A
SCHEMBL30608274 0.84 KDM4E (0.72) MEN1KMT2AKDM4EALDH1A1TDP1
SCHEMBL28402272 0.82 NPC1 (0.51) MAOBACHEMAOAMEN1KMT2A
SCHEMBL8545664 0.82 KDM4E (0.53) MAOBACHEMAOAMEN1KMT2A
SCHEMBL7432074 0.80 ACHE (1.00) MAOBACHEMAOA
SCHEMBL28208744 0.79 NPC1 (0.64) MEN1KMT2AKDM4EALDH1A1TDP1
SCHEMBL8437810 0.78 KDM4E (0.62) MAOBACHEMAOAMEN1KMT2A
SCHEMBL720239 0.78 CASP3 (0.70) MAOBACHEMAOAMEN1KMT2A

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-107827849-B 6- [ 2-hydroxy-3- (alkylamino) propoxy ] benzofuran compound and application thereof 沈阳药科大学 2020-06-02 CN disclosed
CN-107827849-A 6 [2 hydroxyl 3 (alkylamino radical) propoxyl group] benzofuran compounds and its application 沈阳药科大学 2018-03-23 CN disclosed