SCHEMBL21395095

SCHEMBL21395095

Cc1cc(C(C)C)nn(C)c1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
LMNA P02545 2/20 0.36
BRD4 O60885 8/20 0.35
CRHR1 P34998 1/20 0.33
ALDH1A1 P00352 4/20 0.33
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
NPC1 O15118 1/20 0.33
NFKB1 P19838 1/20 0.33
RAB9A P51151 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
HPGD P15428 2/20 0.32
GAA P10253 1/20 0.32
CDK8 P49336 1/20 0.32
ACVR1 Q04771 1/20 0.32

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
SCHEMBL16081467 0.76 SMN1; SMN2 (0.41) SMN1; SMN2LMNABRD4ALDH1A1KDM4E
SCHEMBL21394912 0.75 SMN1; SMN2 (0.39) SMN1; SMN2LMNACRHR1ALDH1A1KMT2A
SCHEMBL2610824 0.73 BAZ2B (0.39) SMN1; SMN2LMNAALDH1A1HPGDGAA
SCHEMBL958691 0.72 BRD4 (0.36) SMN1; SMN2LMNABRD4ALDH1A1KDM4E
SCHEMBL25689955 0.72 BRD4 (0.36) SMN1; SMN2BRD4ALDH1A1KDM4EHPGD
SCHEMBL24077320 0.72 CDK8 (0.40) SMN1; SMN2BRD4ALDH1A1KDM4EHPGD
SCHEMBL24246977 0.69 HTR2C (0.35) SMN1; SMN2LMNABRD4ALDH1A1KDM4E
SCHEMBL12157419 0.69 KDM4E (0.50) LMNABRD4KDM4EHPGDGAA
SCHEMBL2737328 0.69 ALDH1A1 (0.35) ALDH1A1GAANOS3NOS1NOS2
SCHEMBL12368444 0.68 LMNA (0.36) SMN1; SMN2LMNA

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
WO-2024086304-A1 METHODS AND COMPOSITIONS FOR TREATMENT OF OPHTHALMIC DISEASE Design Therapeutics, Inc. (US) 2024-04-25 WO disclosed
WO-2023192642-A2 METHODS AND COMPOUNDS FOR MODULATING HUNTINGTON'S DISEASE Design Therapeutics, Inc. (US) 2023-10-05 WO disclosed
US-20230192666-A1 PIPERAZINE INDAZOLE GLUCOCORTICOID RECEPTOR ANTAGONISTS CORCEPT THERAPEUTICS INCORPORATED 2023-06-22 US disclosed
US-20230192666-A1 PIPERAZINE INDAZOLE GLUCOCORTICOID RECEPTOR ANTAGONISTS CORCEPT THERAPEUTICS INCORPORATED 2023-06-22 US disclosed
WO-2020198026-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-10-01 WO disclosed
WO-2019183587-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2019-09-26 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-20230192666-A1 PIPERAZINE INDAZOLE GLUCOCORTICOID RECEPTOR ANTAGONISTS NR3C1, NR3C2, NR5A2 TLR9 1391/4885TLR8 926/4885TLR7 1054/4885

“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.