SCHEMBL7479804

SCHEMBL7479804

O=C(c1ccccc1)c1cc(C(F)(F)F)cc(F)c1-n1ccnc1NC(=O)C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GLA P06280 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ ABCC9 O60706 2/20 0.36
▸ ABCC8 Q09428 2/20 0.36
▸ KCNJ11 Q14654 2/20 0.36
▸ KCNJ8 Q15842 2/20 0.36
▸ P2RX1 P51575 1/20 0.36
▸ DHODH Q02127 2/20 0.35
▸ POLB P06746 1/20 0.34
▸ NR3C2 P08235 1/20 0.34
▸ CNR2 P34972 3/20 0.34
▸ CNR1 P21554 1/20 0.34
▸ KDR P35968 2/20 0.34
▸ FLT1 P17948 1/20 0.34
▸ FLT4 P35916 1/20 0.34
▸ TRPA1 O75762 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ TRPV1 Q8NER1 1/20 0.33
▸ NR2E1 Q9Y466 1/20 0.33
▸ F2 P00734 1/20 0.33

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
SCHEMBL7478826 0.92 VNN1 (0.35) ABCC9ABCC8KCNJ11KCNJ8P2RX1
SCHEMBL7468466 0.85 ABCC9 (0.38) ABCC9ABCC8KCNJ11KCNJ8DHODH
SCHEMBL7472346 0.84 LMNA (0.36) GLAHPGDABCC9ABCC8KCNJ11
SCHEMBL7470675 0.83 HTT (0.41) GLAHPGDP2RX1CNR2CNR1
SCHEMBL7479307 0.82 GLA (0.39) GLAHPGDP2RX1POLBCNR2
SCHEMBL7476080 0.81 ABCC9 (0.39) GLAHPGDABCC9ABCC8KCNJ11
SCHEMBL7478724 0.78 PDK1 (0.40) GLAHPGDDHODHPOLBNR3C2
SCHEMBL7472543 0.78 ABCC9 (0.38) GLAHPGDABCC9ABCC8KCNJ11
SCHEMBL7474253 0.78 ABCC9 (0.36) ABCC9ABCC8KCNJ11KCNJ8DHODH
SCHEMBL7473084 0.76 ABCC9 (0.34) GLAHPGDABCC9ABCC8KCNJ11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1077701-A4 ANTI-VIRAL COMPOUNDS LILLY CO ELI (US) 2002-03-20 — — EP disclosed
EP-1077701-A1 ANTI-VIRAL COMPOUNDS ELI LILLY AND COMPANY (US) 2001-02-28 — — EP disclosed
WO-1999059587-A1 ANTI-VIRAL COMPOUNDS ELI LILLY AND COMPANY (US) 1999-11-25 — — WO disclosed
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