SCHEMBL12333558

SCHEMBL12333558

CNC(=O)C1C2C=CC(O2)C1C=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPM1B O75688 5/20 0.40
▸ ALDH1A1 P00352 6/20 0.33
▸ L3MBTL1 Q9Y468 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ USP2 O75604 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ POLB P06746 1/20 0.30

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
SCHEMBL21441726 0.76 FPR2 (0.37) ALDH1A1L3MBTL1KMT2AKDM4EGAA
SCHEMBL22863835 0.76 PPM1B (0.33) PPM1B
SCHEMBL6796773 0.76 PPM1B (0.61) PPM1BALDH1A1L3MBTL1KMT2AKDM4E
SCHEMBL9013023 0.74 PPM1B (0.42) PPM1BALDH1A1L3MBTL1KMT2AKDM4E
SCHEMBL19479820 0.72 ALDH1A1 (0.39) ALDH1A1L3MBTL1KDM4EGAACYP1A2
SCHEMBL10050922 0.71 — —
SCHEMBL21733026 0.70 FPR3 (0.35) ALDH1A1L3MBTL1KDM4EGAACYP1A2
SCHEMBL21133701 0.70 ALDH1A1 (0.33) ALDH1A1L3MBTL1KDM4EGAACYP1A2
SCHEMBL19265834 0.68 PPM1B (0.38) PPM1B
SCHEMBL21738139 0.68 ALDH1A1 (0.37) ALDH1A1KMT2AKDM4ETDP1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020155017-A1 A CONJUGATE OF AN AMANITA TOXIN WITH BRANCHED LINKERS HANGZHOU DAC BIOTECH CO., LTD (CN) 2020-08-06 — — WO disclosed
WO-2017046658-A1 DERIVATIVES OF AMANITA TOXINS AND THEIR CONJUGATION TO A CELL BINDING MOLECULE HANGZHOU DAC BIOTECH CO, LTD (CN) 2017-03-23 — — WO disclosed
WO-2011118824-A1 PATTERN FORMING METHOD, CHEMICAL AMPLIFICATION RESIST COMPOSITION AND RESIST FILM FUJIFILM CORPORATION (JP) 2011-09-29 — — WO disclosed
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