SCHEMBL20177703

SCHEMBL20177703

O=C(O)[C@@H]1C(=O)NC[C@H]1c1ccc(Cl)cc1F

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 8/20 0.56
FPR1 P21462 7/20 0.56
SLC6A3 Q01959 8/20 0.43
SLC6A2 P23975 4/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
GPBAR1 Q8TDU6 1/20 0.40
SLC6A4 P31645 2/20 0.39

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
SCHEMBL20177726 0.85 FPR2 (0.54) FPR2FPR1
SCHEMBL20177644 0.84 KDM1A (0.47) FPR2FPR1HTR2A
SCHEMBL20177580 0.82 KDM1A (0.45) FPR2FPR1SLC6A3SLC6A2SLC6A4
SCHEMBL19996023 0.82 FPR2 (0.37) FPR2FPR1SLC6A3SLC6A2HTR2A
SCHEMBL20177892 0.82 FPR2 (0.45) FPR2FPR1SLC6A3
SCHEMBL29434429 0.81 FPR2 (0.58) FPR2FPR1
SCHEMBL18579681 0.81 FPR2 (0.58) FPR2FPR1
SCHEMBL16785453 0.81 FPR2 (0.58) FPR2FPR1
SCHEMBL16799841 0.78 SLC6A3 (0.49) SLC6A3SLC6A2SLC6A4
SCHEMBL4368356 0.77 SLC6A3 (0.61) FPR2FPR1SLC6A3SLC6A2SLC6A4

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-2018092916-A1 NITROGEN-CONTAINING POLYCYCLIC HETEROCYCLIC DERIVATIVE 宇部興産株式会社 2018-05-24 WO disclosed