SCHEMBL9535006

SCHEMBL9535006

CC(=O)N(O)Cc1ccc2c(c1)CCCO2

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CTNNB1 P35222 6/20 0.46
▸ WNT3A P56704 6/20 0.46
▸ AXL P30530 1/20 0.42
▸ MERTK Q12866 1/20 0.42
▸ RAB9A P51151 2/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ KEAP1 Q14145 1/20 0.40
▸ NFE2L2 Q16236 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ POLB P06746 1/20 0.40

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
SCHEMBL9597997 0.86 CTNNB1 (0.46) CTNNB1WNT3AAXLMERTKRAB9A
SCHEMBL9327652 0.76 CTNNB1 (0.55) CTNNB1WNT3ARAB9AKEAP1NFE2L2
SCHEMBL28363090 0.75 CTNNB1 (0.46) CTNNB1WNT3AAXLMERTKRAB9A
SCHEMBL28321960 0.75 CTNNB1 (0.46) CTNNB1WNT3AAXLMERTKRAB9A
SCHEMBL5023473 0.75 CTNNB1 (0.46) CTNNB1WNT3AAXLMERTKRAB9A
SCHEMBL10366473 0.75 CTNNB1 (0.49) CTNNB1WNT3AAXLMERTKRAB9A
SCHEMBL5792636 0.74 CTNNB1 (0.50) CTNNB1WNT3ARAB9AKEAP1NFE2L2
SCHEMBL30730257 0.74 CTNNB1 (0.47) CTNNB1WNT3ARAB9AKCNH2NPC1
SCHEMBL16416836 0.72 CTNNB1 (0.43) CTNNB1WNT3AAXLMERTKRAB9A
SCHEMBL1726294 0.72 CTNNB1 (0.61) CTNNB1WNT3ARAB9ANPC1

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-5256789-A Antiinflammatory hydroxamic acids and N-hydroxyureas PFIZER INC. (US) 1993-10-26 — — US disclosed
EP-0525111-A1 ANTIINFLAMMATORY HYDROXAMIC ACIDS AND N-HYDROXYUREAS. PFIZER (US) 1993-02-03 — — EP disclosed
WO-1991016298-A1 ANTIINFLAMMATORY HYDROXAMIC ACIDS AND N-HYDROXYUREAS PFIZER INC (US) 1991-10-31 — — WO disclosed
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