SCHEMBL7985233

SCHEMBL7985233

CC(Cl)C(=O)c1ccc2c(c1)CC(=O)N2

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 16/20 0.52
AHR P35869 1/20 0.51
EPHX2 P34913 1/20 0.50
HDAC3 O15379 1/20 0.45

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
SCHEMBL29924047 0.88 AHR (0.54) SMYD3AHREPHX2HDAC3
SCHEMBL28566338 0.88 AHR (0.54) SMYD3AHREPHX2HDAC3
SCHEMBL1557916 0.88 SMYD3 (0.54) SMYD3AHREPHX2HDAC3
SCHEMBL7971187 0.87 CRBN (0.51) SMYD3HDAC3
SCHEMBL1459962 0.85 SMYD3 (0.52) SMYD3AHREPHX2HDAC3
SCHEMBL5467073 0.85 CRBN (0.46) SMYD3
SCHEMBL28559882 0.82 SMYD3 (0.51) SMYD3AHREPHX2HDAC3
SCHEMBL29924234 0.82 SMYD3 (0.51) SMYD3AHREPHX2HDAC3
SCHEMBL7414824 0.82 EPHX2 (0.56) SMYD3AHREPHX2
SCHEMBL688076 0.80 EPHX2 (0.56) SMYD3AHREPHX2HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6255322-B1 NERVOUS SYSTEM DISORDERS; ALZHEIMER'S DISEASE PFIZER INC. 2001-07-03 US disclosed
EP-0554247-B1 NEUROPROTECTIVE INDOLONE AND RELATED DERIVATIVES PFIZER (US) 2000-04-26 EP disclosed
US-5498610-A Neuroprotective indolone and related derivatives PFIZER INC. (US) 1996-03-12 US disclosed
EP-0594729-A1 2-(4-HYDROXYPIPERIDINO)-1-ALKANOL DERIVATIVES AS ANTIISCHEMIC AGENTS PFIZER INC. (US) 1994-05-04 EP disclosed
US-5306723-A Neuroprotective indolone and related derivatives PFIZER INC. (US) 1994-04-26 US disclosed
EP-0554247-A1 NEUROPROTECTIVE INDOLONE AND RELATED DERIVATIVES PFIZER INC. (US) 1993-08-11 EP disclosed
WO-1993002052-A1 2-(4-HYDROXYPIPERIDINO)-1-ALKANOL DERIVATIVES AS ANTIISCHEMIC AGENTS PFIZER INC. (US) 1993-02-04 WO disclosed
WO-1991017156-A1 NEUROPROTECTIVE INDOLONE AND RELATED DERIVATIVES PFIZER INC (US) 1991-11-14 WO disclosed
US-4678785-A CARDIOTONICS, ANTICOAGULANTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1987-07-07 US disclosed