SCHEMBL30495458

SCHEMBL30495458

ONN=Cc1cc(Br)ccc1O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 11/20 0.69
KDM4E B2RXH2 8/20 0.69
GAA P10253 1/20 0.69
MAPT P10636 8/20 0.65
POLB P06746 1/20 0.65
MEN1 O00255 6/20 0.60
LMNA P02545 5/20 0.60
HTT P42858 4/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
ALDH1A1 P00352 2/20 0.60
HPGD P15428 1/20 0.60
MAPK1 P28482 1/20 0.60
ASF1A Q9Y294 2/20 0.58
NPC1 O15118 1/20 0.58
MITF O75030 1/20 0.58
RAB9A P51151 1/20 0.58
TDP1 Q9NUW8 1/20 0.58
HSP90AA1 P07900 1/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
PIK3CG P48736 1/20 0.56

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
SCHEMBL13673604 0.85 KMT2A (0.64) KMT2AKDM4EGAAMAPTPOLB
SCHEMBL13673601 0.85 KMT2A (0.64) KMT2AKDM4EGAAMAPTPOLB
SCHEMBL9457623 0.84 KMT2A (0.68) KMT2AKDM4EGAAMAPTPOLB
SCHEMBL13478299 0.84 KMT2A (0.77) KMT2AKDM4EGAAMAPTPOLB
SCHEMBL17438105 0.84 KMT2A (0.77) KMT2AKDM4EGAAMAPTPOLB
SCHEMBL30310017 0.82 KMT2A (1.00) KMT2AKDM4EGAAMAPTPOLB
SCHEMBL6645832 0.82 KDM4E (0.73) KMT2AKDM4EGAAMAPTPOLB
SCHEMBL31393968 0.82 KMT2A (0.74) KMT2AKDM4EGAAMAPTPOLB
SCHEMBL7743114 0.82 KMT2A (0.73) KMT2AKDM4EGAAMAPTPOLB
SCHEMBL7743117 0.82 KMT2A (0.73) KMT2AKDM4EGAAMAPTPOLB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116496194-B Controllable polymorphic multi-step spin cross complex and preparation method thereof 南开大学 2024-08-02 CN claimed
CN-116496194-A Controllable polymorphic multi-step spin cross complex and preparation method thereof 南开大学 2023-07-28 CN claimed
CN-116496194-B Controllable polymorphic multi-step spin cross complex and preparation method thereof 南开大学 2024-08-02 CN disclosed
CN-116496194-B Controllable polymorphic multi-step spin cross complex and preparation method thereof 南开大学 2024-08-02 CN disclosed
CN-116496194-A Controllable polymorphic multi-step spin cross complex and preparation method thereof 南开大学 2023-07-28 CN disclosed