SCHEMBL28069921

SCHEMBL28069921

NCc1cc(F)cc(-c2ccccn2)c1.Nc1c(Cl)cccc1CC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 8/20 0.42
▸ F11 P03951 3/20 0.41
▸ TPSB2 P20231 2/20 0.41
▸ PLAU P00749 2/20 0.41
▸ PLG P00747 1/20 0.41
▸ KLKB1 P03952 1/20 0.41
▸ F7 P08709 1/20 0.41
▸ SUCNR1 Q9BXA5 2/20 0.39
▸ P2RX7 Q99572 1/20 0.38
▸ KAT6A Q92794 3/20 0.38
▸ KDM4C Q9H3R0 2/20 0.37
▸ THRA P10827 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ FFAR1 O14842 1/20 0.36
▸ KAT7 O95251 1/20 0.35
▸ DRD2 P14416 1/20 0.35
▸ METAP2 P50579 1/20 0.35
▸ KAT6B Q8WYB5 1/20 0.35
▸ KAT5 Q92993 1/20 0.35

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
SCHEMBL28069935 0.84 CFD (0.38) CFDF11TPSB2PLAUPLG
SCHEMBL16397300 0.75 CFD (0.59) CFDF11TPSB2PLAUSUCNR1
SCHEMBL16397161 0.72 CFD (0.78) CFDF11TPSB2SUCNR1
SCHEMBL16397052 0.71 AKR1B1 (0.57) —
SCHEMBL16396602 0.69 CFD (0.63) CFDF11TPSB2SUCNR1
SCHEMBL16397190 0.69 CFD (0.58) CFDF11TPSB2PLAUPLG
SCHEMBL16396391 0.68 CFD (0.81) CFDF11TPSB2PLAUPLG
SCHEMBL28069940 0.68 CFD (0.68) CFDF11TPSB2PLAUSUCNR1
SCHEMBL4688780 0.67 FFAR1 (0.60) KAT6AFFAR1
SCHEMBL16410319 0.67 SUCNR1 (0.80) CFDF11TPSB2SUCNR1

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-105555766-A Aminomethyl-biaryl derivatives as complement factor D inhibitors and uses thereof NOVARTIS AG 2016-05-04 — — CN disclosed
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