SCHEMBL9682527

SCHEMBL9682527

c1ccc(-c2ccc3ccccc3c2-c2ncc[nH]2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 2/20 0.54
MTOR P42345 1/20 0.54
ADK P55263 1/20 0.54
ADRA2A P08913 4/20 0.43
ADRA2B P18089 3/20 0.43
ADRA2C P18825 3/20 0.43
CSNK1A1 P48729 2/20 0.43
TYRO3 Q06418 2/20 0.43
DYRK1B Q9Y463 2/20 0.43
IDO1 P14902 1/20 0.40
IKBKB O14920 1/20 0.40
CHUK O15111 1/20 0.40
DAPK3 O43293 1/20 0.40
JAK2 O60674 1/20 0.40
PRKD3 O94806 1/20 0.40
MAP4K4 O95819 1/20 0.40
PAK4 O96013 1/20 0.40
CSF1R P07333 1/20 0.40
RET P07949 1/20 0.40
IGF1R P08069 1/20 0.40

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
SCHEMBL5914840 0.89 NISCH (0.41) NISCHMTORADKADRA2AADRA2B
SCHEMBL14886220 0.85 CSNK1A1 (0.53) NISCHMTORADKADRA2AADRA2B
SCHEMBL5914869 0.85 NISCH (0.39) NISCHMTORADKADRA2AADRA2B
SCHEMBL28349336 0.80 NISCH (0.66) NISCHMTORADKADRA2ACSNK1A1
SCHEMBL7397776 0.80 MAPT (0.50) NISCHMTORADKADRA2AADRA2B
SCHEMBL8342759 0.78 ADRA2A (0.46) NISCHMTORADKADRA2AADRA2B
SCHEMBL3053174 0.78 ADRA2A (0.46) NISCHMTORADKADRA2AADRA2B
SCHEMBL5914817 0.78 NISCH (0.46) NISCHMTORADKADRA2AADRA2B
SCHEMBL9622149 0.78 F2RL1 (0.42) NISCHMTORADKADRA2AADRA2B
SCHEMBL51007 0.77 ADRA2A (0.54) NISCHMTORADKADRA2AADRA2B

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-0479161-A1 Synthesis of heterocyclic compounds EASTMAN CHEMICAL COMPANY (US) 1992-04-08 EP disclosed