SCHEMBL29948556

SCHEMBL29948556

O=C(Nc1cc(NC(=O)[C@H]2[C@H](c3cc(Cl)cc(Cl)c3)C2(Cl)Cl)ccc1Cl)c1ccccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
ALDH1A1 P00352 1/20 0.48
RECQL P46063 1/20 0.48
LMNA P02545 3/20 0.48
MAPK1 P28482 1/20 0.47
HPGD P15428 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
GRM4 Q14833 2/20 0.45
HTT P42858 2/20 0.43
TP53 P04637 1/20 0.43
PKM P14618 1/20 0.42
KDM4E B2RXH2 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
SCHEMBL24730126 1.00 MAPT (0.56) MAPTMEN1KMT2AALDH1A1RECQL
SCHEMBL18147192 0.92 MEN1 (0.48) MAPTMEN1KMT2AALDH1A1RECQL
SCHEMBL18147189 0.92 MEN1 (0.48) MAPTMEN1KMT2AALDH1A1RECQL
SCHEMBL18147186 0.92 MEN1 (0.48) MAPTMEN1KMT2AALDH1A1RECQL
SCHEMBL24730086 0.91 KMT2A (0.51) MAPTMEN1KMT2AALDH1A1RECQL
SCHEMBL24730131 0.91 MEN1 (0.51) MAPTMEN1KMT2AALDH1A1RECQL
SCHEMBL29948396 0.91 KMT2A (0.51) MAPTMEN1KMT2AALDH1A1RECQL
SCHEMBL29948560 0.91 MEN1 (0.51) MAPTMEN1KMT2AALDH1A1RECQL
SCHEMBL24730155 0.88 MEN1 (0.56) MAPTMEN1KMT2AALDH1A1RECQL
SCHEMBL29948365 0.88 MEN1 (0.56) MAPTMEN1KMT2AALDH1A1RECQL

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
EP-4313939-A1 MOLECULES HAVING PESTICIDAL UTILITY AND INTERMEDIATES AND PROCESSES RELATED THERETO Corteva Agriscience LLC (US) 2024-02-07 EP disclosed
WO-2022204080-A1 MOLECULES HAVING PESTICIDAL UTILITY AND INTERMEDIATES AND PROCESSES RELATED THERETO CORTEVA AGRISCIENCE LLC (US) 2022-09-29 WO disclosed