SCHEMBL20076609

SCHEMBL20076609

C=C(Nc1ccc(Cl)c(-c2ccc(F)cc2F)c1)C1C(c2cccc(C)c2)C1(C)Cl

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
ALDH1A1 P00352 2/20 0.35
RECQL P46063 1/20 0.35
CNR1 P21554 1/20 0.35
MAPT P10636 2/20 0.33
GAA P10253 2/20 0.33
KDR P35968 2/20 0.32
LMNA P02545 1/20 0.31
LCK P06239 1/20 0.30
FYN P06241 1/20 0.30
CSF1R P07333 1/20 0.30
LYN P07948 1/20 0.30
KIT P10721 1/20 0.30
SRC P12931 1/20 0.30
FLT1 P17948 1/20 0.30
FLT4 P35916 1/20 0.30
FLT3 P36888 1/20 0.30
BLK P51451 1/20 0.30
EPHX2 P34913 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
SCHEMBL20076606 0.81 MEN1 (0.36) KMT2AMEN1ALDH1A1RECQLMAPT
SCHEMBL20076898 0.80 KMT2A (0.35) KMT2AMEN1ALDH1A1RECQLMAPT
SCHEMBL21020543 0.78 NPC1 (0.33) KMT2AMEN1LMNA
SCHEMBL21020810 0.78 LMNA (0.36) KMT2AMEN1CNR1MAPTLMNA
SCHEMBL21022178 0.77 HTT (0.31) KMT2AMEN1ALDH1A1RECQLLMNA
SCHEMBL20076539 0.76 NPC1 (0.30)
SCHEMBL21021463 0.75
SCHEMBL21022007 0.75 MEN1 (0.30) KMT2AMEN1ALDH1A1MAPT
SCHEMBL21020238 0.75
SCHEMBL21021121 0.74 MEN1 (0.48) KMT2AMEN1ALDH1A1RECQLMAPT

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