SCHEMBL32689799

SCHEMBL32689799

O=C(O)CCc1cc(Cl)ccc1Cl

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 3/20 0.49
GPR17 Q13304 2/20 0.47
ALDH1A1 P00352 1/20 0.47
TP53 P04637 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
HDAC6 Q9UBN7 1/20 0.46
PLAU P00749 1/20 0.45
FFAR4 Q5NUL3 2/20 0.45
PDPK1 O15530 1/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
MAPT P10636 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
TSHR P16473 1/20 0.43
CXCL8 P10145 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL4699761 1.00 FFAR1 (0.49) FFAR1GPR17ALDH1A1TP53NPSR1
Trifluoroacetic Acid SCHEMBL34475873 0.92 FFAR1 (0.43) FFAR1GPR17ALDH1A1TP53NPSR1
SCHEMBL7905467 0.87 F13A1 (0.53) FFAR1ALDH1A1TP53MAPTTDP1
SCHEMBL27860622 0.86 ALDH1A1 (0.44) ALDH1A1TP53PDPK1MAPTTDP1
SCHEMBL20672330 0.86 F13A1 (0.56) FFAR1MAPT
SCHEMBL586345 0.85 PDPK1 (0.59) FFAR1GPR17ALDH1A1PDPK1
SCHEMBL1418003 0.85 HIF1A (0.59) FFAR1GPR17NPSR1HDAC6PLAU
SCHEMBL30567601 0.85 PDPK1 (0.59) FFAR1GPR17ALDH1A1PDPK1
SCHEMBL14430375 0.83 FFAR1 (0.54) FFAR1GPR17NPSR1HDAC6PLAU
SCHEMBL3732327 0.83 POLB (0.46) FFAR1GPR17NPSR1FFAR4

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
EP-4712969-A1 CYCLIN INHIBITORS Circle Pharma, Inc. (US) 2026-03-25 EP disclosed