SCHEMBL29948529

SCHEMBL29948529

Nc1c(F)ccc(C(=O)Nc2cc(NC(=O)[C@H]3[C@H](c4ccc(F)c(C(F)(F)F)c4)C3(Cl)Cl)ccc2Cl)c1F

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
LMNA P02545 2/20 0.40
ALDH1A1 P00352 1/20 0.38
RECQL P46063 1/20 0.38
MAPT P10636 3/20 0.38
MAPK1 P28482 1/20 0.38
BRAF P15056 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
TMPRSS4 Q9NRS4 1/20 0.36
TP53 P04637 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
SMO Q99835 1/20 0.35
GRM4 Q14833 1/20 0.35
PYGL P06737 1/20 0.35
THRB P10828 1/20 0.34
FADS1 O60427 1/20 0.34
HTT P42858 1/20 0.34

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
SCHEMBL24730161 1.00 MEN1 (0.40) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL29995163 0.90 KMT2A (0.40) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL29948411 0.90 MEN1 (0.40) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL22898701 0.90 KMT2A (0.40) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL24730607 0.90 MEN1 (0.40) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL18146714 0.90 KMT2A (0.40) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL18146712 0.90 KMT2A (0.40) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL20050897 0.90 KMT2A (0.40) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL24730081 0.88 HDAC1 (0.43) MEN1KMT2ALMNAALDH1A1RECQL
SCHEMBL29948418 0.88 HDAC1 (0.43) MEN1KMT2ALMNAALDH1A1RECQL

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