SCHEMBL5423713

SCHEMBL5423713

CC(C)(C)OC(=O)N1CCCC2(CCN(Cc3ccc(Oc4ccccc4)cc3)C2=O)C1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 1/20 0.48
HDAC1 Q13547 3/20 0.47
HDAC6 Q9UBN7 3/20 0.47
HDAC8 Q9BY41 2/20 0.47
RIPK1 Q13546 1/20 0.44
CYP3A4 P08684 3/20 0.41
CYP2D6 P10635 3/20 0.41
CYP1A2 P05177 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MMP2 P08253 1/20 0.40
MMP13 P45452 1/20 0.40
MMP14 P50281 1/20 0.40
ADAM17 P78536 1/20 0.40
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 2/20 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
SCHEMBL5423537 0.89 HDAC1 (0.44) USP30HDAC1HDAC6HDAC8RIPK1
SCHEMBL5422216 0.86 RIPK1 (0.47) HDAC1HDAC6HDAC8RIPK1CYP3A4
SCHEMBL5426355 0.84 USP30 (0.45) USP30HDAC1HDAC6HDAC8RIPK1
SCHEMBL5428076 0.83 USP30 (0.63) USP30CYP3A4MMP2MMP13MMP14
SCHEMBL30801697 0.82 HDAC1 (0.45) USP30HDAC1HDAC6HDAC8RIPK1
SCHEMBL17608805 0.81 HDAC1 (0.55) USP30HDAC1HDAC6HDAC8RIPK1
SCHEMBL24718689 0.80 RIPK1 (0.65) USP30HDAC1HDAC6HDAC8RIPK1
SCHEMBL3499124 0.78 USP30 (0.47) USP30HDAC1HDAC6HDAC8MMP2
Hydrochloric Acid SCHEMBL5431787 0.78 MEN1 (0.48) RIPK1CYP3A4CYP2D6CYP1A2CYP2C9
SCHEMBL5427242 0.78 USP30 (0.45) USP30HDAC1HDAC6HDAC8RIPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070275990-A1 Heterocyclic Spiro Compound ONO PHARMACEUTICAL CO., LTD. 2007-11-29 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 (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-20070275990-A1 Heterocyclic Spiro Compound NR3C2, CBR1, CBR3 USP30 4584/4885HDAC1 113/4885HDAC6 266/4885

“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.