SCHEMBL6750168

SCHEMBL6750168

[InH2]Oc1ccc2ccccc2n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ NCF1 P14598 3/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ NOS2 P35228 1/20 0.46
▸ BACE1 P56817 1/20 0.46
▸ CA12 O43570 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.42
▸ GLA P06280 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ ACHE P22303 1/20 0.42
▸ MGAM O43451 1/20 0.41
▸ CYSLTR2 Q9NS75 1/20 0.40
▸ CYSLTR1 Q9Y271 1/20 0.40
▸ NPC1 O15118 6/20 0.39
▸ RAB9A P51151 6/20 0.39
▸ AR P10275 2/20 0.39
▸ CYP3A4 P08684 1/20 0.39

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
SCHEMBL31498821 0.81 NCF1 (0.50) MAPTMEN1KMT2ANCF1CYP1A2
SCHEMBL1131286 0.81 NCF1 (0.50) MAPTMEN1KMT2ANCF1CYP1A2
Phosphine SCHEMBL23753735 0.79 MAPT (0.49) MAPTMEN1KMT2ANCF1CYP1A2
SCHEMBL6026855 0.77 MAPT (0.47) MAPTMEN1KMT2ANCF1CYP1A2
SCHEMBL7942319 0.77 MAPT (0.47) MAPTMEN1KMT2ANCF1CYP1A2
SCHEMBL17440166 0.77 MAPT (0.47) MAPTMEN1KMT2ANCF1CYP1A2
SCHEMBL5593982 0.77 MAPT (0.47) MAPTMEN1KMT2ANCF1CYP1A2
SCHEMBL4458474 0.77 MAPT (0.47) MAPTMEN1KMT2ANCF1CYP1A2
SCHEMBL9826905 0.77 NCF1 (0.52) MAPTMEN1KMT2ANCF1CYP1A2
SCHEMBL29392943 0.77 KDM4E (0.53) MAPTMEN1KMT2ANCF1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040115173-A1 Method of treating inflammation, particularly diabetes NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-06-17 — — US disclosed
WO-2002066619-A1 METHODS OF TREATING INFLAMMATION, PARTICULARLY DIABETES THE WISTAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2002-08-29 — — WO disclosed
EP-1221974-A2 MAGNETIC TARGETED CARRIER Ferx Incorporated (US) 2002-07-17 — — EP disclosed
WO-2001028587-A2 MAGNETIC TARGETED CARRIER FERX INCORPORATED (US) 2001-04-26 — — WO disclosed
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