SCHEMBL14430243

SCHEMBL14430243

Cc1cc(F)c(O)c(N=O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SELL P14151 1/20 0.41
▸ SELP P16109 1/20 0.41
▸ SELE P16581 1/20 0.41
▸ ERN1 O75460 2/20 0.34
▸ GRIN2D O15399 1/20 0.34
▸ GRIN3B O60391 1/20 0.34
▸ GRIN1 Q05586 1/20 0.34
▸ GRIN2A Q12879 1/20 0.34
▸ GRIN2B Q13224 1/20 0.34
▸ GRIN2C Q14957 1/20 0.34
▸ GRIN3A Q8TCU5 1/20 0.34
▸ LMNA P02545 3/20 0.33
▸ HTT P42858 2/20 0.33
▸ GPR35 Q9HC97 1/20 0.32
▸ ALDH1A1 P00352 4/20 0.32
▸ KDM4E B2RXH2 3/20 0.31
▸ MAPT P10636 3/20 0.31
▸ POLB P06746 2/20 0.31
▸ GAA P10253 2/20 0.31
▸ APEX1 P27695 1/20 0.31

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
SCHEMBL28193096 0.84 SELL (0.43) SELLSELPSELEERN1GRIN2D
SCHEMBL13425237 0.83 SELL (0.56) SELLSELPSELEERN1GRIN2D
SCHEMBL3278166 0.78 ALDH1A1 (0.46) SELLSELPSELEERN1GRIN2D
SCHEMBL24749274 0.78 RAPGEF4 (0.35) LMNAHTT
SCHEMBL14430050 0.77 MEN1 (0.41) SELLSELPSELEERN1GRIN2D
SCHEMBL129716 0.77 SELL (0.58) SELLSELPSELEERN1LMNA
SCHEMBL18892671 0.75 SELL (0.41) SELLSELPSELEERN1GRIN2D
SCHEMBL270851 0.75 MEN1 (0.42) SELLSELPSELEERN1GRIN2D
SCHEMBL1001590 0.74 GRIN2D (0.36) ERN1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL12588326 0.72 SELL (0.68) SELLSELPSELEERN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2220046-B1 INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION GILEAD SCIENCES INC (US) 2014-06-18 — — EP disclosed
EP-1820515-A1 NITROGEN-CONTAINING FUSED RING COMPOUND AND USE THEREOF Japan Tobacco, Inc. (JP) 2007-08-22 — — EP disclosed
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