SCHEMBL27200564

SCHEMBL27200564

C=Cc1ccc(C[P+](CCCC)(CCCC)CCCC)cc1.F[B-](F)(F)F

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 11/20 0.56
CCR5 P51681 1/20 0.37
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ALDH1A1 P00352 1/20 0.34
DNM1 Q05193 1/20 0.31
THRA P10827 1/20 0.30
THRB P10828 1/20 0.30
SPHK1 Q9NYA1 1/20 0.30

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
SCHEMBL23001576 0.94 BDKRB2 (0.55) BDKRB2CCR5TAS1R3TAS1R1CA1
SCHEMBL30120525 0.94 BDKRB2 (0.62) BDKRB2CCR5TAS1R3TAS1R1CA1
Iodide SCHEMBL7630309 0.92 BDKRB2 (0.61) BDKRB2CCR5TAS1R3TAS1R1CA1
Bromide SCHEMBL7634854 0.92 BDKRB2 (0.61) BDKRB2CCR5TAS1R3TAS1R1CA1
Hydrochloric Acid SCHEMBL548534 0.92 BDKRB2 (0.66) BDKRB2CCR5TAS1R3TAS1R1CA1
SCHEMBL30901612 0.87 BDKRB2 (0.62) BDKRB2CCR5TAS1R3TAS1R1CA1
Bromide SCHEMBL7627895 0.86 BDKRB2 (0.65) BDKRB2CCR5TAS1R3TAS1R1CA1
Bromide SCHEMBL7635711 0.86 BDKRB2 (0.65) BDKRB2CCR5TAS1R3TAS1R1CA1
Hydrochloric Acid SCHEMBL6389237 0.86 BDKRB2 (0.65) BDKRB2CCR5TAS1R3TAS1R1CA1
Hydrochloric Acid SCHEMBL7636190 0.86 BDKRB2 (0.65) BDKRB2CCR5TAS1R3TAS1R1CA1

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-3762131-B1 MEMBRANES CONTAINING POLYMERIZED IONIC LIQUID FOR USE IN GAS SEPARATION CONSIGLIO NAZ DELLE RICERCHE CNR (IT) 2024-04-24 EP disclosed