SCHEMBL23446366

SCHEMBL23446366

O=CNC(CCC(=O)NC(CCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1)C(=O)NC(CCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ ACE P12821 1/20 0.45
▸ CCKBR P32239 1/20 0.40
▸ PTPN1 P18031 2/20 0.40
▸ NOD2 Q9HC29 1/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ CA4 P22748 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ MBTPS1 Q14703 1/20 0.40
▸ CTSB P07858 1/20 0.39
▸ CTSL P07711 1/20 0.39
▸ MME P08473 1/20 0.39
▸ ANPEP P15144 1/20 0.39
▸ MMP9 P14780 1/20 0.39
▸ FOLH1 Q04609 1/20 0.39

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
SCHEMBL22300310 0.95 ALDH1A1 (0.49) KMT2AALDH1A1MEN1HPGDACE
SCHEMBL24235590 0.95 KMT2A (0.49) KMT2AALDH1A1MEN1HPGDACE
SCHEMBL23447603 0.95 MEN1 (0.43) KMT2AALDH1A1MEN1HPGDACE
SCHEMBL23463370 0.93 ALDH1A1 (0.45) KMT2AALDH1A1MEN1HPGDACE
SCHEMBL23447185 0.93 KMT2A (0.45) KMT2AALDH1A1MEN1HPGDACE
SCHEMBL23475284 0.90 MEN1 (0.53) KMT2AALDH1A1MEN1HPGDCCKBR
SCHEMBL23445990 0.88 KMT2A (0.45) KMT2AALDH1A1MEN1HPGDACE
SCHEMBL13996825 0.87 ALDH1A1 (0.48) KMT2AALDH1A1MEN1HPGDACE
SCHEMBL28222599 0.87 ALDH1A1 (0.48) KMT2AALDH1A1MEN1HPGDACE
SCHEMBL23475261 0.86 MEN1 (0.50) KMT2AALDH1A1MEN1HPGDACE

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-2022022360-A1 POLYETHYLENE GLYCOL CONJUGATE DRUG, AND PREPARATION METHOD THERFOR AND USE THEREOF 重庆阿普格雷生物科技有限公司 2022-02-03 — — WO disclosed
WO-2022022354-A1 POLYETHYLENE GLYCOL CONJUGATE DRUG SYNERGIST, PREPARATION METHOD THEREFOR, AND USE THEREOF 重庆阿普格雷生物科技有限公司 2022-02-03 — — WO disclosed
WO-2021104120-A1 POLYETHYLENE GLYCOL CONJUGATE MEDICAMENT, PREPARATION METHOD THERFOR AND USE THEREOF 重庆阿普格雷生物科技有限公司 2021-06-03 — — WO disclosed
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