SCHEMBL30286388

SCHEMBL30286388

Cc1cc(Br)c(O)c(-c2ccccc2F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
POLB P06746 1/20 0.40
CASP3 P42574 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
GABRA1 P14867 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRA2 P47869 1/20 0.39
GABRB2 P47870 1/20 0.39
CA12 O43570 1/20 0.38
CA9 Q16790 1/20 0.38
F2 P00734 5/20 0.37
F10 P00742 5/20 0.37
PLG P00747 5/20 0.37
PLAU P00749 5/20 0.37
PRSS1 P07477 5/20 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
SCHEMBL24086818 1.00 MAPT (0.40) MAPTHPGDSMN1; SMN2POLBCASP3
SCHEMBL24086757 0.81 GABRA1 (0.38) HPGDGABRA1GABRB1GABRA2GABRB2
SCHEMBL880200 0.81 GABRA1 (0.56) MAPTHPGDSMN1; SMN2POLBGABRA1
SCHEMBL17166655 0.79 AMY1A (0.48) MAPTHPGDSMN1; SMN2GABRA1GABRB1
SCHEMBL13045187 0.79 CRHBP (0.48) HPGDGABRA1GABRB1GABRA2GABRB2
SCHEMBL9102556 0.77 CRHBP (0.37) MAPTHPGDSMN1; SMN2NPSR1GABRA1
SCHEMBL24086742 0.77 MAPT (0.40) MAPTHPGDSMN1; SMN2ERN1
SCHEMBL13044875 0.77 F2 (0.42) MAPTGABRA1GABRB1GABRA2GABRB2
SCHEMBL24086817 0.77 F2 (0.39) GABRA1GABRB1GABRA2GABRB2F2
SCHEMBL5086984 0.77 CRHBP (0.53) HPGDF2F10PLGPLAU

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
CN-115873041-A Organic electroluminescent material and device 环球展览公司 2023-03-31 CN disclosed