SCHEMBL6954666

SCHEMBL6954666

OCC(c1ccc(F)cc1)c1ncc[nH]1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2RL1 P55085 16/20 0.43
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38

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
SCHEMBL6952503 0.85 MTOR (0.44) F2RL1ADRA2AADRA2BADRA2C
SCHEMBL954931 0.84 F2RL1 (0.46) F2RL1ADRA2AADRA2BADRA2C
SCHEMBL3529538 0.81 F2RL1 (0.44) F2RL1ADRA2AADRA2BADRA2C
SCHEMBL8653269 0.79 CYP19A1 (0.42) F2RL1
SCHEMBL6955109 0.79 F2RL1 (0.51) F2RL1
SCHEMBL3527344 0.78 F2RL1 (0.39) F2RL1ADRA2AADRA2BADRA2C
SCHEMBL10642682 0.78 F2RL1 (0.42) F2RL1
SCHEMBL3526362 0.76 F2RL1 (0.41) F2RL1
SCHEMBL8194262 0.75 SMN1; SMN2 (0.41) F2RL1ADRA2AADRA2BADRA2C
SCHEMBL6953526 0.75 CFTR (0.46) ADRA2AADRA2BADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1276725-A2 5-SUBSTITUTED TETRALONES AS INHIBITORS OF RAS FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 2003-01-22 EP disclosed
WO-2001079180-A2 5-SUBSTITUTED TETRALONES AS INHIBITORS OF RAS FARNESYL TRANSFERASE WARNER-LAMBERT COMPANY (US) 2001-10-25 WO disclosed
EP-1054865-A1 FARNESYL TRANSFERASE INHIBITORS AstraZeneca UK Limited (GB) 2000-11-29 EP disclosed
EP-1025088-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS AstraZeneca UK Limited (GB) 2000-08-09 EP disclosed
WO-1999041235-A1 FARNESYL TRANSFERASE INHIBITORS ASTRAZENECA UK LIMITED (GB) 1999-08-19 WO disclosed
WO-1999020611-A1 IMIDAZOLE DERIVATIVES AND THEIR USE AS FARNESYL PROTEIN TRANSFERASE INHIBITORS ZENECA LIMITED (GB) 1999-04-29 WO disclosed