SCHEMBL29025481

SCHEMBL29025481

FC(F)C(F)(F)Oc1cc(Cl)c(OCCCOc2ncc(C(F)(F)F)cc2Cl)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.43
RAB9A P51151 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 2/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
SCN9A Q15858 2/20 0.38
KMT2A Q03164 1/20 0.38
MAPK1 P28482 1/20 0.38
FFAR1 O14842 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
SCHEMBL29025582 0.90 TDP1 (0.34) SMN1; SMN2RAB9ACYP1A2CYP3A4CYP2C19
SCHEMBL29025584 0.86 SMN1; SMN2 (0.43) SMN1; SMN2RAB9AMRGPRX4CYP1A2CYP3A4
SCHEMBL29025478 0.85 SMN1; SMN2 (0.42) SMN1; SMN2RAB9AMRGPRX4CYP1A2CYP3A4
SCHEMBL30432517 0.84 LMNA (0.48) SMN1; SMN2RAB9ACYP1A2CYP3A4CYP2C19
SCHEMBL29025474 0.84 LMNA (0.48) SMN1; SMN2RAB9ACYP1A2CYP3A4CYP2C19
SCHEMBL29025590 0.83 SMN1; SMN2 (0.41) SMN1; SMN2RAB9AMRGPRX4CYP1A2CYP3A4
SCHEMBL29025591 0.82 KMT2A (0.41) SMN1; SMN2MRGPRX4TDP1L3MBTL1LMNA
SCHEMBL7075911 0.81 RAB9A (0.51) SMN1; SMN2RAB9AMRGPRX4CYP1A2CYP3A4
SCHEMBL29025583 0.81 SMN1; SMN2 (0.32) SMN1; SMN2RAB9ACYP1A2CYP3A4CYP2C19
SCHEMBL7076374 0.79 RAB9A (0.51) SMN1; SMN2RAB9AMRGPRX4CYP1A2CYP3A4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116178249-B Ether derivative with insecticidal and acaricidal activities as well as preparation method and application thereof 北京亦农生物科技有限公司 2024-02-09 CN disclosed
CN-116178249-A Ether derivative with insecticidal and acaricidal activities as well as preparation method and application thereof 北京亦农生物科技有限公司 2023-05-30 CN disclosed