SCHEMBL29201130

SCHEMBL29201130

Nc1ccc(-c2ccc(C(=O)O)cc2)c(N)c1C(=O)O.Nc1ccc(-c2ccc(N)c(C(=O)O)c2)c(C(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
THRB P10828 2/20 0.50
RECQL P46063 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
MCL1 Q07820 2/20 0.50
USP2 O75604 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
PKM P14618 1/20 0.50
APEX1 P27695 1/20 0.50
BLM P54132 1/20 0.50
KDM4E B2RXH2 3/20 0.48
GFER P55789 1/20 0.48
RXFP1 Q9HBX9 1/20 0.48
FOLH1 Q04609 1/20 0.44
HSD17B10 Q99714 2/20 0.38
RARB P10826 1/20 0.38
RARG P13631 1/20 0.38
RXRA P19793 1/20 0.38

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
SCHEMBL4584345 0.84 KMT2A (0.70) KMT2AMEN1THRBRECQLTDP1
SCHEMBL28352021 0.83 TP53 (0.43) KMT2AKDM4EGFERRXFP1FOLH1
SCHEMBL4582858 0.75 HSD17B10 (0.58) KMT2AMEN1THRBRECQLTDP1
SCHEMBL28337327 0.74 FOLH1 (0.45) KMT2AKDM4EGFERRXFP1FOLH1
SCHEMBL8960627 0.73 KDM4E (0.81) KMT2AMEN1THRBRECQLTDP1
SCHEMBL1708791 0.72 KMT2A (0.48) KMT2AMEN1THRBRECQLTDP1
SCHEMBL29464078 0.72 KMO (0.50) FOLH1RXRAKEAP1TDP2MAP4K4
SCHEMBL9851132 0.72 KMO (0.50) FOLH1RXRAKEAP1TDP2MAP4K4
SCHEMBL107833 0.72 KMT2A (0.95) KMT2AMEN1THRBRECQLTDP1
SCHEMBL2890556 0.70 FOLH1 (0.57) KMT2AMEN1THRBRECQLTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117624596-A Liquid crystal aligning agent, liquid crystal alignment film, liquid crystal display element and manufacturing method thereof 日产化学株式会社 2024-03-01 CN disclosed