SCHEMBL10812685

SCHEMBL10812685

CCNc1ccc(Nc2cccc(N)c2)c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GNG2 P59768 2/20 0.57
▸ GNB1 P62873 2/20 0.57
▸ P2RY4 P51582 12/20 0.49
▸ P2RY12 Q9H244 8/20 0.46
▸ P2RY2 P41231 6/20 0.46
▸ P2RY6 Q15077 3/20 0.46
▸ MAPK1 P28482 2/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ LMNA P02545 2/20 0.44
▸ GAA P10253 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ USP2 O75604 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ THRB P10828 1/20 0.44
▸ CFTR P13569 1/20 0.44
▸ APEX1 P27695 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ BLM P54132 1/20 0.44

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
SCHEMBL11786902 0.89 GNG2 (0.67) GNG2GNB1P2RY4P2RY12P2RY2
SCHEMBL10811570 0.88 GNG2 (0.55) GNG2GNB1P2RY4P2RY12P2RY2
SCHEMBL10812150 0.85 GNG2 (0.60) GNG2GNB1P2RY4P2RY12P2RY2
SCHEMBL10809844 0.84 GNG2 (0.54) GNG2GNB1P2RY4P2RY12P2RY2
SCHEMBL10415363 0.84 GNG2 (0.62) GNG2GNB1P2RY4P2RY12P2RY2
SCHEMBL10816305 0.83 GNG2 (0.58) GNG2GNB1P2RY4P2RY12P2RY2
SCHEMBL10808217 0.82 GNG2 (0.62) GNG2GNB1P2RY4P2RY12P2RY2
SCHEMBL10809797 0.81 GNG2 (0.61) GNG2GNB1P2RY4P2RY12P2RY2
SCHEMBL78525 0.80 MEN1 (0.60) MAPK1MEN1LMNAGAAMAPT
SCHEMBL29366166 0.80 MEN1 (0.60) MAPK1MEN1LMNAGAAMAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4676803-A Reactive azo dyestuffs, free from anionic groups and containing a basic group and halogenotriazinyl radical and useful for dyeing cellulose/polyester BAYER AKTIENGESELLSCHAFT (DE) 1987-06-30 — — US disclosed
EP-0022209-B1 FLUOR-TRIAZINE DYESTUFFS AND THEIR USE IN DYEING CELLULOSIC FIBROUS MATERIALS BAYER AG (DE) 1985-04-17 — — EP disclosed
US-4503224-A FIBER-REACTIVE, COTTON-POLYESTER BLENDS BAYER AKTIENGESELLSCHAFT (DE) 1985-03-05 — — US disclosed
EP-0019728-B1 UTILISATION OF REACTIVE DYESTUFFS IN DYEING AND PRINTING BLENDED FABRICS POLYESTER/COTTON BAYER AG (DE) 1983-01-12 — — EP disclosed
EP-0022209-A2 Fluor-triazine dyestuffs and their use in dyeing cellulosic fibrous materials BAYER AG (DE) 1981-01-14 — — EP disclosed
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