SCHEMBL20177843

SCHEMBL20177843

O=C(Nc1ccc(F)cc1)N[C@@H]1C2=NOCCN2C[C@H]1c1ccc(Cl)cc1F

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 15/20 0.67
FPR1 P21462 14/20 0.56
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL20177483 0.90 FPR2 (0.79) FPR2FPR1MAPTSMN1; SMN2
SCHEMBL20177550 0.89 FPR2 (0.67) FPR2FPR1MAPTSMN1; SMN2KDM4E
SCHEMBL20177523 0.89 FPR2 (0.67) FPR2FPR1
SCHEMBL20177830 0.87 FPR2 (0.71) FPR2FPR1MAPTSMN1; SMN2
SCHEMBL20177545 0.87 FPR2 (0.66) FPR2FPR1MAPTSMN1; SMN2
SCHEMBL20177603 0.83 FPR2 (0.66) FPR2FPR1MAPTSMN1; SMN2ALDH1A1
SCHEMBL20177479 0.83 FPR2 (0.79) FPR2FPR1
SCHEMBL18264322 0.80 FPR2 (1.00) FPR2FPR1
SCHEMBL18264324 0.80 FPR2 (1.00) FPR2FPR1
SCHEMBL20177811 0.80 FPR2 (0.66) FPR2FPR1

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