SCHEMBL28803795

SCHEMBL28803795

F[B-](F)(F)F.O=C(O)Cn1ccc(=O)[nH]c1=O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
LMNA P02545 1/20 0.54
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
ATM Q13315 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.47
CA1 P00915 5/20 0.46
CA2 P00918 5/20 0.46
CA4 P22748 5/20 0.46
CA9 Q16790 5/20 0.46
PKM P14618 1/20 0.43
DUT P33316 6/20 0.43
CRBN Q96SW2 1/20 0.42

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
SCHEMBL28803862 0.98 ALDH1A1 (0.52) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL29167329 0.97 ALDH1A1 (0.51) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL2899640 0.93 ALDH1A1 (0.59) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL27703786 0.78 ALDH1A1 (0.55) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL11710750 0.77 ALDH1A1 (0.58) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL11710759 0.77 ALDH1A1 (0.58) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL11983580 0.77 ALDH1A1 (0.58) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL1673256 0.76 KMT2A (0.42) ALDH1A1LMNAKDM4EMEN1KMT2A
SCHEMBL8135756 0.76 DUT (0.58) ALDH1A1LMNAL3MBTL1DUT
SCHEMBL667245 0.75 ALDH1A1 (0.59) ALDH1A1LMNAKDM4EMEN1KMT2A

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-114702514-A 2,2' -bipyridine and uracil-1-base acetic acid copper tetrafluoroborate complex and preparation method and application thereof 温州大学新材料与产业技术研究院 2022-07-05 CN claimed
CN-114702514-A 2,2' -bipyridine and uracil-1-base acetic acid copper tetrafluoroborate complex and preparation method and application thereof 温州大学新材料与产业技术研究院 2022-07-05 CN disclosed