SCHEMBL31019683

SCHEMBL31019683

Cc1ccc(CCNC(=O)c2c(CO)nn(C)c2Oc2cccc(C(F)(F)F)c2)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 5/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
POLB P06746 1/20 0.44
PTGER2 P43116 1/20 0.43
GPR52 Q9Y2T5 4/20 0.42
PPARG P37231 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
MAPT P10636 2/20 0.39
RAB9A P51151 1/20 0.38
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CCR2 P41597 1/20 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
SCHEMBL31019684 0.89 PTGER4 (0.45) PTGER4SMN1; SMN2POLBPTGER2GPR52
SCHEMBL31019718 0.89 PTGER4 (0.46) PTGER4SMN1; SMN2POLBPTGER2GPR52
SCHEMBL31019734 0.89 PTGER4 (0.48) PTGER4SMN1; SMN2POLBPTGER2GPR52
SCHEMBL31019731 0.88 PTGER4 (0.48) PTGER4SMN1; SMN2POLBPTGER2GPR52
SCHEMBL31019709 0.88 PTGER4 (0.45) PTGER4SMN1; SMN2POLBPTGER2PPARG
SCHEMBL31019704 0.86 PTGER4 (0.45) PTGER4SMN1; SMN2POLBPTGER2PPARG
SCHEMBL31019730 0.83 PTGER4 (0.42) PTGER4SMN1; SMN2POLBPTGER2GPR52
SCHEMBL27220804 0.77 PPARG (0.41) PTGER4PPARGPPARDPPARAMAPT
SCHEMBL24053193 0.77 PPARG (0.41) SMN1; SMN2POLBPPARGPPARDPPARA
SCHEMBL24053187 0.77 PPARG (0.41) SMN1; SMN2POLBPPARGPPARDPPARA

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-2024162284-A1 PYRAZOLE-4-CARBOXAMIDE COMPOUND AND AGRICULTURAL OR HORTICULTURAL PLANT DISEASE CONTROL AGENT USING SAME クミアイ化学工業株式会社 2024-08-08 WO disclosed