SCHEMBL178698

SCHEMBL178698

O=C(NCCCC[C@@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.66
MDM2 Q00987 6/20 0.55
MDM4 O15151 1/20 0.54
TP53 P04637 1/20 0.54
TLR2 O60603 2/20 0.54
FOLH1 Q04609 2/20 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
SCHEMBL29528567 1.00 KMT2A (0.66) KMT2AMDM2MDM4TP53TLR2
SCHEMBL260631 1.00 KMT2A (0.66) KMT2AMDM2MDM4TP53TLR2
SCHEMBL29401258 1.00 KMT2A (0.66) KMT2AMDM2MDM4TP53TLR2
SCHEMBL29359997 1.00 KMT2A (0.66) KMT2AMDM2MDM4TP53TLR2
SCHEMBL178733 1.00 KMT2A (0.66) KMT2AMDM2MDM4TP53TLR2
SCHEMBL29423590 0.97 KMT2A (0.64) KMT2AMDM2MDM4TP53TLR2
SCHEMBL29401604 0.97 KMT2A (0.64) KMT2AMDM2MDM4TP53TLR2
SCHEMBL119708 0.97 KMT2A (0.64) KMT2AMDM2MDM4TP53TLR2
SCHEMBL18148920 0.97 KMT2A (0.64) KMT2AMDM2MDM4TP53TLR2
SCHEMBL119709 0.97 KMT2A (0.64) KMT2AMDM2MDM4TP53TLR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020252713-A1 MODIFIED HYDROPHOBIC AUXILIARY MATERIAL, PREPARATION METHOD THEREFOR AND USE THEREOF 浙江智达药业有限公司 2020-12-24 WO claimed
WO-2020252713-A1 MODIFIED HYDROPHOBIC AUXILIARY MATERIAL, PREPARATION METHOD THEREFOR AND USE THEREOF 浙江智达药业有限公司 2020-12-24 WO disclosed
US-8895231-B2 Patterning process and resist composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-11-25 US disclosed
US-20120058428-A1 PATTERNING PROCESS AND RESIST COMPOSITION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-03-08 US disclosed
EP-0010297-B1 DERIVATIVES OF POLYENE MACROLIDE ANTIBIOTICS CONTAINING AN AMINO SUGAR MOIETY, PROCESS FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SCHERING CORPORATION (US) 1983-04-13 EP disclosed
US-4272525-A FUNGICIDES SCHERING CORPORATION (US) 1981-06-09 US disclosed
EP-0010297-A1 Derivatives of polyene macrolide antibiotics containing an amino sugar moiety, process for the preparation thereof, and pharmaceutical compositions containing them SCHERING CORPORATION (US) 1980-04-30 EP disclosed