SCHEMBL29948604

SCHEMBL29948604

O=C(Nc1cc(NC(=O)[C@H]2[C@H](c3cc(Cl)cc(Cl)c3)C2(Cl)Cl)ccc1Cl)c1ccc(F)cc1F

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.50
MEN1 O00255 4/20 0.50
LMNA P02545 4/20 0.50
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
TDP1 Q9NUW8 1/20 0.41
SNCA P37840 1/20 0.41
ALDH1A1 P00352 2/20 0.41
RECQL P46063 1/20 0.41
HDAC1 Q13547 1/20 0.41
MAPT P10636 3/20 0.40
MAPK1 P28482 1/20 0.40
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
GRM4 Q14833 1/20 0.37
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TRPV1 Q8NER1 1/20 0.37

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
SCHEMBL24730592 1.00 KMT2A (0.50) KMT2AMEN1LMNANPC1RAB9A
SCHEMBL24730026 0.94 MEN1 (0.46) KMT2AMEN1LMNANPC1RAB9A
SCHEMBL29948394 0.93 KMT2A (0.51) KMT2AMEN1LMNANPC1RAB9A
SCHEMBL24730236 0.91 MEN1 (0.48) KMT2AMEN1LMNAALDH1A1RECQL
SCHEMBL29948438 0.91 MEN1 (0.48) KMT2AMEN1LMNAALDH1A1RECQL
SCHEMBL24730086 0.89 KMT2A (0.51) KMT2AMEN1LMNANPC1RAB9A
SCHEMBL29948396 0.89 KMT2A (0.51) KMT2AMEN1LMNANPC1RAB9A
SCHEMBL18146137 0.89 KMT2A (0.50) KMT2AMEN1LMNAALDH1A1RECQL
SCHEMBL21586778 0.89 KMT2A (0.50) KMT2AMEN1LMNAALDH1A1RECQL
SCHEMBL18146133 0.89 KMT2A (0.50) KMT2AMEN1LMNAALDH1A1RECQL

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