SCHEMBL20076606

SCHEMBL20076606

C=C(Nc1ccc(Cl)c(-c2ccc(C)cc2C)c1)C1C(c2cccc(Cl)c2)C1(C)Cl

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
ALDH1A1 P00352 2/20 0.36
RECQL P46063 1/20 0.36
HTT P42858 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
SLC9A1 P19634 2/20 0.35
SMO Q99835 1/20 0.33
S1PR4 O95977 1/20 0.32
MAPT P10636 4/20 0.32
GAA P10253 1/20 0.32
HSP90AA1 P07900 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
TP53 P04637 1/20 0.31
AGPAT2 O15120 1/20 0.31
KCNK3 O14649 1/20 0.31
KCNK9 Q9NPC2 1/20 0.31

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
SCHEMBL20076609 0.81 KMT2A (0.35) MEN1KMT2AALDH1A1RECQLLMNA
SCHEMBL21021463 0.79
SCHEMBL21020662 0.77 MEN1 (0.31) MEN1KMT2AALDH1A1HTTLMNA
SCHEMBL21022007 0.77 MEN1 (0.30) MEN1KMT2AALDH1A1MAPT
SCHEMBL21020810 0.75 LMNA (0.36) MEN1KMT2AHTTLMNAHPGD
SCHEMBL21020543 0.75 NPC1 (0.33) MEN1KMT2ALMNASLC9A1
SCHEMBL21021036 0.75 USP28 (0.31) MEN1KMT2AHTTLMNAMAPT
SCHEMBL21022178 0.74 HTT (0.31) MEN1KMT2AALDH1A1RECQLHTT
SCHEMBL21020672 0.74 MEN1 (0.33) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL20076898 0.74 KMT2A (0.35) 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