SCHEMBL9675147

SCHEMBL9675147

Cc1nn(C)c(Oc2cccc(C(F)(F)F)c2)c1C=NOCCOc1ccc(C(C)(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.42
LTA4H P09960 1/20 0.41
CYP1A2 P05177 2/20 0.40
CYP2C9 P11712 2/20 0.40
CYP2C19 P33261 2/20 0.40
PTGER4 P35408 2/20 0.39
P2RY1 P47900 1/20 0.37
L3MBTL1 Q9Y468 4/20 0.36
PPARG P37231 3/20 0.36
PPARA Q07869 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALOX15 P16050 1/20 0.36
MOGAT2 Q3SYC2 1/20 0.35
ALDH1A1 P00352 2/20 0.34
DRD2 P14416 1/20 0.34
PLA2G1B P04054 1/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ATG4B Q9Y4P1 1/20 0.34

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
SCHEMBL9672859 0.88 SMN1; SMN2 (0.40) POLBSMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL9673192 0.78 POLB (0.60) POLBSMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL9673200 0.78 POLB (0.60) POLBSMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL10564195 0.75 SMN1; SMN2 (0.36) SMN1; SMN2CYP1A2CYP2C9CYP2C19L3MBTL1
SCHEMBL9674027 0.75 NR1I3 (0.41) SMN1; SMN2CYP1A2CYP2C9CYP2C19L3MBTL1
SCHEMBL9673356 0.74 SMN1; SMN2 (0.42) SMN1; SMN2LTA4HCYP1A2CYP2C9CYP2C19
SCHEMBL13243036 0.74 SMN1; SMN2 (0.41) POLBSMN1; SMN2CYP1A2CYP2C9CYP2C19
SCHEMBL10434807 0.73 SMN1; SMN2 (0.39) SMN1; SMN2LTA4HCYP1A2CYP2C9CYP2C19
SCHEMBL9672273 0.73 L3MBTL1 (0.45) SMN1; SMN2L3MBTL1PPARGALDH1A1MAPT
SCHEMBL9261813 0.72 LMNA (0.39) SMN1; SMN2CYP1A2CYP2C9CYP2C19L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0234045-B1 A PYRAZOLE OXIME DERIVATIVE AND ITS PRODUCTION AND USE NIHON NOHYAKU CO., LTD. (JP) 1992-09-02 EP disclosed
US-4843068-A INSECTICIDES, MITICIDES, FUNGICIDES NIHON NOHYAKU CO., LTD. (JP) 1989-06-27 US disclosed
EP-0234045-A2 A pyrazole oxime derivative and its production and use NIHON NOHYAKU CO., LTD. (JP) 1987-09-02 EP disclosed