SCHEMBL7667019

SCHEMBL7667019

CCCc1cnc(-c2ccccc2Oc2ccc(F)cc2F)cn1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ALOX5AP P20292 6/20 0.38
▸ FEN1 P39748 6/20 0.38
▸ FFAR1 O14842 1/20 0.37
▸ MAPK8 P45983 1/20 0.37
▸ MAPK14 Q16539 1/20 0.37
▸ BRD4 O60885 3/20 0.37
▸ HSPB1 P04792 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ SREBF2 Q12772 1/20 0.36
▸ RXRB P28702 1/20 0.36

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
SCHEMBL7664751 0.82 HTR2A (0.40) L3MBTL1ALOX5APFEN1
SCHEMBL7664382 0.80 SLC6A2 (0.43) L3MBTL1SREBF2
SCHEMBL7673906 0.78 KEAP1 (0.39) L3MBTL1ALDH1A1HTTSREBF2
SCHEMBL7668578 0.76 L3MBTL1 (0.36) L3MBTL1ALOX5APFEN1ALDH1A1SREBF2
SCHEMBL7666933 0.75 CYP11B1 (0.42) FEN1ALDH1A1SREBF2
SCHEMBL7666782 0.70 NPC1 (0.38) L3MBTL1ALOX5APFEN1SREBF2
SCHEMBL7670839 0.70 CYP11B1 (0.41) ALDH1A1
SCHEMBL7664372 0.70 PLAU (0.41) L3MBTL1ALDH1A1HTT
SCHEMBL15060590 0.69 ALOX5AP (0.45) L3MBTL1ALOX5APFEN1
SCHEMBL10462079 0.68 PDE5A (0.41) TRPA1ALOX5APFEN1BRD4SREBF2

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
US-6458813-B1 2-CYCLOHEXYLOXY-5-(2-CHLOROPHENYLCARBONYLAMINO)PYRIDINE, FOR EXAMPLE; TREATING INFLAMMATION, PAIN, DIABETES, CANCER AMGEN INC. 2002-10-01 — — US disclosed
US-6333341-B1 TUMOR NECROSIS FACTOR, ANTIINFLAMMATORY AGENTS AND ANALGESICS AMGEN INC. 2001-12-25 — — US disclosed
US-6184237-B1 Substituted pyridine compounds and methods of use AMGEN INC. 2001-02-06 — — US disclosed
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