SCHEMBL20116368

SCHEMBL20116368

CC(C)n1ncc2ccc(-c3nc(C4CCN(C(=O)CC(C)(C)C)C4)no3)cc21

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 6/20 0.42
HTR4 Q13639 2/20 0.38
USP7 Q93009 1/20 0.37
SCD5 Q86SK9 1/20 0.37
HSD11B1 P28845 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
PTGER3 P43115 1/20 0.36

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
SCHEMBL22358288 0.95 USP7 (0.40) USP30HTR4USP7SMN1; SMN2LMNA
SCHEMBL20116273 0.93 USP30 (0.41) USP30HTR4USP7SCD5HSD11B1
SCHEMBL20116353 0.87 USP30 (0.54) USP30
SCHEMBL22357992 0.85 SMN1; SMN2 (0.44) SMN1; SMN2ALDH1A1LMNAPOLBTSHR
SCHEMBL20117082 0.84 TBK1 (0.44) USP30HTR4USP7SMN1; SMN2ALDH1A1
SCHEMBL22358472 0.83 USP30 (0.48) USP30USP7SMN1; SMN2ALDH1A1TSHR
SCHEMBL20116506 0.82 SMO (0.42) USP30HTR4USP7SMN1; SMN2ALDH1A1
SCHEMBL20116372 0.82 HTR4 (0.39) USP30HTR4USP7SCD5SMN1; SMN2
SCHEMBL22358188 0.81 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1LMNATSHR
SCHEMBL20116268 0.81 USP30 (0.46) USP30SCD5HSD11B1ALDH1A1PTGER3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-11873298-B2 Compounds and uses thereof JANSSEN PHARMACEUTICA NV (BE) 2024-01-16 US disclosed
US-20200262828-A1 COMPOUNDS AND USES THEREOF JANSSEN PHARMACEUTICA NV (BE) 2020-08-20 US disclosed
WO-2019209948-A9 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-01-02 WO disclosed
WO-2019018795-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2019-01-24 WO disclosed
WO-2018081167-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2018-05-03 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 (2 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-11873298-B2 Compounds and uses thereof NLN, ACHE, CLN6 USP30 3526/4885HTR4 482/4885USP7 4265/4885
US-20200262828-A1 COMPOUNDS AND USES THEREOF NLN, ACHE, CLN6 USP30 3526/4885HTR4 482/4885USP7 4265/4885

“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.