SCHEMBL9664664

SCHEMBL9664664

CCOc1cc(-n2nc(C)c(Cl)c2C)c(F)cc1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPOX P50336 6/20 0.44
SLC34A1 Q06495 6/20 0.36
KDM4E B2RXH2 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
PDE4B Q07343 1/20 0.36
MAPT P10636 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CCR1 P32246 1/20 0.34
TUBB4A P04350 1/20 0.34
TUBB P07437 1/20 0.34
TUBA3C P0DPH7 1/20 0.34
TUBA1B P68363 1/20 0.34
TUBA4A P68366 1/20 0.34
TUBB4B P68371 1/20 0.34
TUBB3 Q13509 1/20 0.34
TUBB2A Q13885 1/20 0.34
TUBB8 Q3ZCM7 1/20 0.34
TUBA3E Q6PEY2 1/20 0.34
TUBA1A Q71U36 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
SCHEMBL9661971 0.86 PPOX (0.57) PPOXKDM4EPDE4BMAPTSMN1; SMN2
SCHEMBL9661744 0.85 PGK1 (0.39) PPOXSLC34A1SMN1; SMN2P2RX7ALDH1A1
SCHEMBL9663448 0.80 PPOX (0.45) PPOXKDM4ECYP1A2CYP2C19MAPT
SCHEMBL10871506 0.80 PPOX (0.37) PPOXPDE4BP2RX7
SCHEMBL9661593 0.80 POLB (0.34) PPOXSLC34A1PDE4BMAPTSMN1; SMN2
SCHEMBL9663236 0.76 POLB (0.39) SLC34A1KDM4EMAPTP2RX7LMNA
SCHEMBL9661657 0.75 PPOX (0.46) PPOXSMN1; SMN2P2RX7ALDH1A1LMNA
SCHEMBL9663274 0.75 PGK1 (0.39) PPOXPDE4BSMN1; SMN2P2RX7ALDH1A1
SCHEMBL9662543 0.73 PGK1 (0.38) PPOXSLC34A1PDE4BMAPTSMN1; SMN2
SCHEMBL9663189 0.73 PGK1 (0.41) PPOXCYP2C19PDE4BALDH1A1LMNA

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-0202169-B1 NEW PYRAZOLE DERIVATIVES, THEIR PRODUCTION AND USES HOKKO CHEMICAL INDUSTRY CO., LTD (JP) 1992-11-19 EP disclosed
US-4752326-A 1-arylpyrazoles, composition containing them, and herbicidal method of using them HOKKO CHEMICAL INDUSTRY CO., LTD. (JP) 1988-06-21 US disclosed
EP-0202169-A1 New pyrazole derivatives, their production and uses HOKKO CHEMICAL INDUSTRY CO., LTD (JP) 1986-11-20 EP disclosed