SCHEMBL20076431

SCHEMBL20076431

C=C(c1ccc(C)cc1F)c1cc(NC(=C)C2C(c3cc(Cl)cc(Cl)c3)C2(Cl)Cl)ccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
ALDH1A1 P00352 2/20 0.37
RECQL P46063 1/20 0.37
LMNA P02545 4/20 0.34
HTT P42858 3/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 2/20 0.34
MAPT P10636 2/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
MAPK1 P28482 1/20 0.30
IDO1 P14902 1/20 0.30

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
SCHEMBL21021436 0.88 HTT (0.37) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21021274 0.84 HTT (0.36) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21021736 0.81 KMT2A (0.38) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21022006 0.80 MEN1 (0.39) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21022201 0.79 MEN1 (0.37) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21022107 0.79 MEN1 (0.35) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21022022 0.79 MEN1 (0.32) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21021544 0.78 RAB9A (0.48) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL20076459 0.77 KMT2A (0.37) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL20076465 0.77 NPC1 (0.31) MEN1KMT2AALDH1A1RECQLHTT

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
WO-2018071327-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2018-04-19 WO disclosed