SCHEMBL21021544

SCHEMBL21021544

C=C(Nc1ccc(Cl)c(C(=O)Nc2ccc(C)cc2C(F)(F)F)c1)C1C(c2cc(Cl)cc(Cl)c2)C1(Cl)Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.48
MAPT P10636 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
TP53 P04637 1/20 0.48
KDM4E B2RXH2 1/20 0.42
GRM4 Q14833 1/20 0.41
HTT P42858 2/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
NPC1 O15118 1/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
RECQL P46063 1/20 0.37
TMPRSS4 Q9NRS4 1/20 0.37
RORC P51449 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
PTGES O14684 2/20 0.36

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
SCHEMBL18147788 0.82 MEN1 (0.47) RAB9AMAPTSMN1; SMN2TP53KDM4E
SCHEMBL18147790 0.82 MEN1 (0.47) RAB9AMAPTSMN1; SMN2TP53KDM4E
SCHEMBL18147794 0.82 MEN1 (0.47) RAB9AMAPTSMN1; SMN2TP53KDM4E
SCHEMBL18147123 0.80 KMT2A (0.48) RAB9AMAPTSMN1; SMN2KDM4EGRM4
SCHEMBL21021436 0.80 HTT (0.37) RAB9AMAPTSMN1; SMN2HTTLMNA
SCHEMBL18147127 0.80 KMT2A (0.48) RAB9AMAPTSMN1; SMN2KDM4EGRM4
SCHEMBL18147130 0.80 KMT2A (0.48) RAB9AMAPTSMN1; SMN2KDM4EGRM4
SCHEMBL18160457 0.79 HTT (0.60) RAB9AMAPTSMN1; SMN2TP53HTT
SCHEMBL20076431 0.78 MEN1 (0.37) RAB9AMAPTSMN1; SMN2KDM4EHTT
SCHEMBL19651303 0.78 KMT2A (0.48) RAB9AMAPTSMN1; SMN2HTTLMNA

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