SCHEMBL19630709

SCHEMBL19630709

O=C1CCCC(N2Cc3c(cccc3[N+](=O)[O-])C2=O)C(=O)N1

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 10/20 0.60
IKZF3 Q9UKT9 5/20 0.58
DDB1 Q16531 4/20 0.58
TNF P01375 4/20 0.58
IKZF1 Q13422 3/20 0.58
IL1B P01584 3/20 0.58
BRD4 O60885 1/20 0.58
MAP1LC3B Q9GZQ8 8/20 0.47
CSNK1A1 P48729 1/20 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
SCHEMBL18270887 1.00 CRBN (0.60) CRBNIKZF3DDB1TNFIKZF1
SCHEMBL28608567 0.94 CRBN (0.64) CRBNIKZF3DDB1TNFIKZF1
SCHEMBL29505690 0.93 CRBN (0.69) CRBNIKZF3DDB1TNFIKZF1
SCHEMBL1978451 0.93 CRBN (0.69) CRBNIKZF3DDB1TNFIKZF1
SCHEMBL1398964 0.93 CRBN (0.69) CRBNIKZF3DDB1TNFIKZF1
SCHEMBL10192708 0.93 CRBN (0.69) CRBNIKZF3DDB1TNFIKZF1
SCHEMBL33677 0.93 CRBN (0.69) CRBNIKZF3DDB1TNFIKZF1
Hydrochloric Acid SCHEMBL27957670 0.92 CRBN (0.67) CRBNIKZF3DDB1TNFIKZF1
SCHEMBL19359318 0.89 CRBN (0.54) CRBNIKZF3DDB1TNFIKZF1
SCHEMBL19359315 0.89 CRBN (0.54) CRBNIKZF3DDB1TNFIKZF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170333443-A1 CHIMERIC COMPOUNDS TARGETING PROTEINS, COMPOSITIONS, METHODS, AND USES THEREOF BIOTHERYX, INC. 2017-11-23 US disclosed
WO-2017201069-A1 OXOINDOLINE DERIVATIVES AS PROTEIN FUNCTION MODULATORS BIOTHERYX, INC. (US) 2017-11-23 WO 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 (1 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-20170333443-A1 CHIMERIC COMPOUNDS TARGETING PROTEINS, COMPOSITIONS, METHODS, AND USES THEREOF IKZF3, IKZF1, CKS1B CRBN 176/4885IKZF3 1/4885DDB1 2485/4885

“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.