SCHEMBL10168336

SCHEMBL10168336

C=C1CCC(N2Cc3c(O)cccc3C2=O)C(=O)N1

nearest known ligand 0.77

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 9/20 0.77
IKZF3 Q9UKT9 2/20 0.58
DDB1 Q16531 2/20 0.58
IKZF1 Q13422 2/20 0.58
BRD4 O60885 1/20 0.58
TNF P01375 1/20 0.58
IL1B P01584 1/20 0.58
CSNK1A1 P48729 1/20 0.47
MAP1LC3B Q9GZQ8 11/20 0.46

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
SCHEMBL20442491 0.87 CRBN (1.00) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL31727916 0.87 CRBN (1.00) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL29453150 0.87 CRBN (1.00) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL1097880 0.87 CRBN (1.00) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL677652 0.86 CRBN (0.78) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL17246851 0.86 CRBN (0.78) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL25036187 0.84 CRBN (0.80) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL18878463 0.83 CRBN (0.55) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL25467709 0.83 CRBN (0.55) CRBNIKZF3DDB1IKZF1BRD4
SCHEMBL25467697 0.83 CRBN (0.55) CRBNIKZF3DDB1IKZF1BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180155316-A1 4'-O-SUBSTITUTED ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CELGENE CORPORATION 2018-06-07 US disclosed
US-9920027-B2 4′-O-substituted isoindoline derivatives and compositions comprising and methods of using the same CELGENE CORPORATION (US) 2018-03-20 US disclosed
US-RE46639-E1 4′-O-substituted isoindoline derivatives and compositions comprising and methods of using the same CELGENE CORPORATION (US) 2017-12-19 US disclosed
US-20160024048-A1 4'-O-SUBSTITUTED ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CELGENE CORPORATION 2016-01-28 US disclosed
US-9181216-B2 4′-O-substituted isoindoline derivatives and compositions comprising and methods of using the same CELGENE CORPORATION (US) 2015-11-10 US disclosed
US-20140073669-A1 4'-O-SUBSTITUTED ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CELGENE CORPORATION 2014-03-13 US disclosed
US-20120165536-A1 4'-O-SUBSTITUTED ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CELGENE CORPORATION 2012-06-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140073669-A1 4'-O-SUBSTITUTED ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CYP3A4, CYP3A7, CYP4B1 CRBN 3542/4885IKZF3 3179/4885DDB1 2458/4885
US-20160024048-A1 4'-O-SUBSTITUTED ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CYP3A4, CYP3A7, CYP4B1 CRBN 3542/4885IKZF3 3179/4885DDB1 2458/4885
US-20120165536-A1 4'-O-SUBSTITUTED ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CYP3A4, CYP3A7, CYP4B1 CRBN 3542/4885IKZF3 3179/4885DDB1 2458/4885
US-20180155316-A1 4'-O-SUBSTITUTED ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME CYP3A4, CYP3A7, CYP4B1 CRBN 3542/4885IKZF3 3179/4885DDB1 2458/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.