SCHEMBL31362960

SCHEMBL31362960

CCOC(=O)c1c(Oc2cccc(C(F)(F)F)c2)cnn1-c1nccs1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.41
HTT P42858 1/20 0.41
ATM Q13315 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40
MAPT P10636 6/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
GAA P10253 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
RAB9A P51151 4/20 0.39
NPC1 O15118 3/20 0.39
BRAF P15056 2/20 0.39
APP P05067 1/20 0.39

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
SCHEMBL31363077 0.88 PPARG (0.43) KDM4EPPARGPPARAMAPTKMT2A
SCHEMBL31362950 0.77 RAB9A (0.36) KDM4EHTTMAPTGAAL3MBTL1
SCHEMBL12890284 0.71 HPGD (0.60) KDM4ESMN1; SMN2MAPTMEN1KMT2A
SCHEMBL31405509 0.71 ATM (0.49) KDM4ESMN1; SMN2ATMPPARGPPARA
SCHEMBL31405505 0.71 PPARG (0.51) SMN1; SMN2PPARGPPARAMAPTKMT2A
SCHEMBL31719628 0.71 PPARG (0.47) SMN1; SMN2PPARGPPARAMAPTGAA
SCHEMBL16398928 0.70 KDM4E (0.57) KDM4ESMN1; SMN2HTTATMMAPT
SCHEMBL31363074 0.70 KDM4E (0.50) KDM4ESMN1; SMN2HTTATMMAPT
SCHEMBL875911 0.69 RAB9A (0.54) KDM4ESMN1; SMN2HTTL3MBTL1ALDH1A1
SCHEMBL7375948 0.69 KDM4E (0.57) KDM4ESMN1; SMN2HTTMEN1KMT2A

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-2025033011-A1 FIVE-MEMBERED HETEROARYL COMPOUND AND AGRICULTURAL AND HORTICULTURAL BACTERICIDE 日本曹達株式会社 2025-02-13 WO disclosed