SCHEMBL10749366

SCHEMBL10749366

OC(c1ccc(Cl)cc1)C1CCC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.47
SLC6A2 P23975 3/20 0.45
SLC6A4 P31645 3/20 0.45
SLC6A3 Q01959 2/20 0.45
GAA P10253 1/20 0.44
HPGD P15428 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
FPR2 P25090 2/20 0.43
PROKR1 Q8TCW9 2/20 0.43
HRH3 Q9Y5N1 1/20 0.41
RPS6KB1 P23443 1/20 0.40
AOC3 Q16853 1/20 0.39
AKT1 P31749 1/20 0.38
CHRM1 P11229 1/20 0.38
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR7 P34969 1/20 0.37
HSD17B2 P37059 1/20 0.37

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
SCHEMBL8611840 0.96 DHODH (0.51) DHODHSLC6A2SLC6A4SLC6A3GAA
SCHEMBL28438873 0.94 DHODH (0.54) DHODHSLC6A2SLC6A4SLC6A3GAA
Cyclopropane SCHEMBL6425247 0.92 DHODH (0.47) DHODHSLC6A2SLC6A4SLC6A3GAA
SCHEMBL1349046 0.91 FPR2 (0.45) DHODHSLC6A2SLC6A4SLC6A3GAA
SCHEMBL16423035 0.89 AKT1 (0.51) DHODHSLC6A2SLC6A4SLC6A3SMN1; SMN2
SCHEMBL16400056 0.82 SLC6A4 (0.53) SLC6A2SLC6A4SLC6A3FPR2PROKR1
SCHEMBL16861575 0.82 BCL2A1 (0.49) DHODHHPGDFPR2PROKR1HRH3
SCHEMBL3391983 0.80 HRH3 (0.55) SLC6A2SLC6A4SLC6A3FPR2PROKR1
SCHEMBL7456086 0.79 OPRM1 (0.45) SLC6A2SLC6A4SLC6A3GAAHPGD
SCHEMBL3051979 0.79 HTR2A (0.55) DHODHHRH3RPS6KB1AOC3HTR2A

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
US-4670454-A FUNGICIDES BASF AKTIENGESELLSCHAFT (DE) 1987-06-02 US disclosed