SCHEMBL21021682

SCHEMBL21021682

C=C(C)c1cc(NC(=O)C2CC2(C)C)ccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.40
TSHR P16473 1/20 0.40
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
RORC P51449 1/20 0.39
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
HTT P42858 1/20 0.38
ACKR3 P25106 1/20 0.38
KDM4E B2RXH2 1/20 0.37
POLB P06746 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NPC1 O15118 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
SCHEMBL21021769 0.91 RAB9A (0.40) RAB9ATSHRMEN1KMT2ALMNA
SCHEMBL20076562 0.80 MEN1 (0.35) RAB9AMEN1KMT2ALMNASMN1; SMN2
SCHEMBL21020245 0.78 MEN1 (0.39) RAB9ATSHRMEN1KMT2ALMNA
SCHEMBL31087876 0.77 NAMPT (0.61) RAB9ATSHRMEN1KMT2ASMN1; SMN2
SCHEMBL21450030 0.74 RAB9A (0.56) RAB9AMEN1KMT2ASMN1; SMN2GAA
SCHEMBL13999156 0.73 ALDH1A1 (0.43) RAB9AMEN1KMT2ALMNAGAA
SCHEMBL13690000 0.72 L3MBTL1 (0.55) MEN1KMT2ALMNASMN1; SMN2RORC
SCHEMBL21022120 0.72 KMT2A (0.36) RAB9ATSHRMEN1KMT2ALMNA
SCHEMBL13999152 0.72 MAPT (0.50) RAB9AMEN1KMT2AGAAPOLB
SCHEMBL13689807 0.71 ALDH1A1 (0.48) RAB9AMEN1KMT2ALMNASMN1; SMN2

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
EP-3283459-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-05-22 EP disclosed